N-[3-[[4-methoxy-3-(phenylmethyl)phenyl]amino]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[3-[[4-methoxy-3-(phenylmethyl)phenyl]amino]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[3-(3-benzyl-4-methoxy-anilino)-3-oxo-propyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[3-[4-methoxy-3-(phenylmethyl)anilino]-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[3-(3-benzyl-4-methoxyanilino)-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: N-[3-(3-benzyl-4-methoxy-anilino)-3-keto-propyl]-4-keto-4-(2-thienyl)butyramide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCNC(=O)CCC(=O)C2=CC=CS2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCNC(=O)CCC(=O)C2=CC=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O4S/c1-31-22-11-9-20(17-19(22)16-18-6-3-2-4-7-18)27-25(30)13-14-26-24(29)12-10-21(28)23-8-5-15-32-23/h2-9,11,15,17H,10,12-14,16H2,1H3,(H,26,29)(H,27,30)