4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(4-cyanophenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(4-cyanophenyl)butyramide Formula: C18H15N3OS2 MolecularWeight: 353.4612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H15N3OS2/c19-12-13-7-9-14(10-8-13)20-17(22)6-3-11-23-18-21-15-4-1-2-5-16(15)24-18/h1-2,4-5,7-10H,3,6,11H2,(H,20,22)