N-[3-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[3-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[3-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]-3-oxo-propyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[3-[[(1-methyl-2-imidazolyl)-phenylmethyl]amino]-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[3-[[(1-methylimidazol-2-yl)-phenylmethyl]amino]-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-[3-keto-3-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]propyl]-4-(2-thienyl)butyramide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CCNC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CCNC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C22H24N4O3S/c1-26-14-13-24-22(26)21(16-6-3-2-4-7-16)25-20(29)11-12-23-19(28)10-9-17(27)18-8-5-15-30-18/h2-8,13-15,21H,9-12H2,1H3,(H,23,28)(H,25,29)