955640-35-4
BENZENESULFONAMIDE, N-[5-[(HEXAHYDRO-1H-AZEPIN-1-YL)CARBONYL]-4-METHYL-2-THIAZOLYL]-
NameBENZENESULFONAMIDE, N-[5-[(HEXAHYDRO-1H-AZEPIN-1-YL)CARBONYL]-4-METHYL-2-THIAZOLYL]-
1Identification
【Name】
BENZENESULFONAMIDE, N-[5-[(HEXAHYDRO-1H-AZEPIN-1-YL)CARBONYL]-4-METHYL-2-THIAZOLYL]-
【CAS】
【MDL】
MFCD15528218
【English Synonyms】
【Formula】
C17 H21 N3 O3 S2
【MolWeight】
379.503
【Inchi】
InChI=1S/C17H21N3O3S2/c1-13-15(16(21)20-11-7-2-3-8-12-20)24-17(18-13)19-25(22,23)14-9-5-4-6-10-14/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H,18,19)
【InChIKey】
InChIKey=BNJZHGWEHWYCMF-UHFFFAOYSA-N
【SMILES】
Cc1c(sc(n1)NS(=O)(=O)c2ccccc2)C(=O)N3CCCCCC3
【MOL File】
BENZENESULFONAMIDE, ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZENESULFONAMIDE, N-[5-[(HEXAHYDRO-1H-AZEPIN-1-YL)CARBONYL]-4-METHYL-2-THIAZOLYL]-.cml