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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(phenylmethylsulfanyl)butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfanyl-N-(2-furylmethyl)butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-(phenylmethylthio)butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfanyl-N-(furan-2-ylmethyl)butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(benzylthio)-N-(2-furfuryl)butyramide Formula: C23H22N2O2S2 MolecularWeight: 422.56298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O2S2/c26-22(13-7-15-28-17-18-8-2-1-3-9-18)25(16-19-10-6-14-27-19)23-24-20-11-4-5-12-21(20)29-23/h1-6,8-12,14H,7,13,15-17H2