N-[3-[1-(4-imidazol-1-ylphenyl)ethylamino]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCNC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)CCNC(=O)CCC(=O)C3=CC=CS3

InChI

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