587004-34-0
3,4,6-TRICHLORO-N-[(4-CHLOROPHENYL)METHYL]-N-(TETRAHYDRO-1,1-DIOXIDO-3-THIENYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE
Name3,4,6-TRICHLORO-N-[(4-CHLOROPHENYL)METHYL]-N-(TETRAHYDRO-1,1-DIOXIDO-3-THIENYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE
FormulaC20 H15 Cl4 N O3 S2
1Identification
【Name】
3,4,6-TRICHLORO-N-[(4-CHLOROPHENYL)METHYL]-N-(TETRAHYDRO-1,1-DIOXIDO-3-THIENYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE
【CAS】
【MDL】
MFCD04031402
【English Synonyms】
【Formula】
C20 H15 Cl4 N O3 S2
【MolWeight】
523.286
【Inchi】
InChI=1S/C20H15Cl4NO3S2/c21-12-3-1-11(2-4-12)9-25(14-5-6-30(27,28)10-14)20(26)19-18(24)17-15(23)7-13(22)8-16(17)29-19/h1-4,7-8,14H,5-6,9-10H2
【InChIKey】
InChIKey=JOYOMDSFBYQEFJ-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1CN(C2CCS(=O)(=O)C2)C(=O)c3c(c4c(s3)cc(cc4Cl)Cl)Cl)Cl
【MOL File】
3,4,6-TRICHLORO-N-[(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,4,6-TRICHLORO-N-[(4-CHLOROPHENYL)METHYL]-N-(TETRAHYDRO-1,1-DIOXIDO-3-THIENYL)-BENZO[B]THIOPHENE-2-CARBOXAMIDE.cml