4-(5-chloranylthiophen-2-yl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxidanylidene-butanamide Openeye Name: 4-(5-chloro-2-thienyl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxo-butanamide CAS Name: 4-(5-chloro-2-thiophenyl)-N-[1-[4-(1-imidazolyl)phenyl]ethyl]-4-oxobutanamide IUPAC Name: 4-(5-chlorothiophen-2-yl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxobutanamide Traditional Name: 4-(5-chloro-2-thienyl)-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-keto-butyramide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C19H18ClN3O2S/c1-13(14-2-4-15(5-3-14)23-11-10-21-12-23)22-19(25)9-6-16(24)17-7-8-18(20)26-17/h2-5,7-8,10-13H,6,9H2,1H3,(H,22,25)