N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-(phenylmethylsulfanyl)butanamide Openeye Name: N-benzyl-4-benzylsulfanyl-N-(5-methoxy-1,3-benzothiazol-2-yl)butanamide CAS Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-(phenylmethylthio)butanamide IUPAC Name: N-benzyl-4-benzylsulfanyl-N-(5-methoxy-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-benzyl-4-(benzylthio)-N-(5-methoxy-1,3-benzothiazol-2-yl)butyramide Formula: C26H26N2O2S2 MolecularWeight: 462.62684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCSCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCSCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O2S2/c1-30-22-14-15-24-23(17-22)27-26(32-24)28(18-20-9-4-2-5-10-20)25(29)13-8-16-31-19-21-11-6-3-7-12-21/h2-7,9-12,14-15,17H,8,13,16,18-19H2,1H3