N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(phenylmethyl)sulfonyl-butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(phenylmethyl)sulfonyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfonyl-N-(2-furylmethyl)butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-(phenylmethyl)sulfonylbutanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfonyl-N-(furan-2-ylmethyl)butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfonyl-N-(2-furfuryl)butyramide Formula: C23H22N2O4S2 MolecularWeight: 454.56178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCCC(=O)N(CC2=CC=CO2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCCC(=O)N(CC2=CC=CO2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H22N2O4S2/c26-22(13-7-15-31(27,28)17-18-8-2-1-3-9-18)25(16-19-10-6-14-29-19)23-24-20-11-4-5-12-21(20)30-23/h1-6,8-12,14H,7,13,15-17H2