4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylsulfonyl-butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylsulfonyl-butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-indan-1-yl-N-methylsulfonyl-butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylsulfonylbutanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,3-dihydro-1H-inden-1-yl)-N-methylsulfonylbutanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-indan-1-yl-N-mesyl-butyramide Formula: C21H22N2O3S3 MolecularWeight: 446.60598

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1CCC2=CC=CC=C12)C(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)N(C1CCC2=CC=CC=C12)C(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N2O3S3/c1-29(25,26)23(18-13-12-15-7-2-3-8-16(15)18)20(24)11-6-14-27-21-22-17-9-4-5-10-19(17)28-21/h2-5,7-10,18H,6,11-14H2,1H3