N-(1,3-benzothiazol-2-ylmethyl)-4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(5-chloro-2-thienyl)-4-oxo-butanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(5-chloro-2-thiophenyl)-4-oxobutanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(5-chlorothiophen-2-yl)-4-oxobutanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(5-chloro-2-thienyl)-4-keto-butyramide Formula: C16H13ClN2O2S2 MolecularWeight: 364.86962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNC(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNC(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H13ClN2O2S2/c17-14-7-6-13(22-14)11(20)5-8-15(21)18-9-16-19-10-3-1-2-4-12(10)23-16/h1-4,6-7H,5,8-9H2,(H,18,21)