1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(2-thienylmethyl)thiourea CAS Name: 1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(2-thenyl)thiourea Formula: C25H25N3O2S2 MolecularWeight: 463.6149

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)N(CC2=CC=CS2)CC3=CC4=C(C=C(C=C4)OC)NC3=O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=S)N(CC2=CC=CS2)CC3=CC4=C(C=C(C=C4)OC)NC3=O

InChI

InChI=1S/C25H25N3O2S2/c1-17(18-7-4-3-5-8-18)26-25(31)28(16-22-9-6-12-32-22)15-20-13-19-10-11-21(30-2)14-23(19)27-24(20)29/h3-14,17H,15-16H2,1-2H3,(H,26,31)(H,27,29)