1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(2-thienylmethyl)thiourea CAS Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(2-thenyl)thiourea Formula: C26H27N3OS2 MolecularWeight: 461.64208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)C(=S)NC(C)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)C(=S)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3OS2/c1-3-19-11-12-24-21(14-19)15-22(25(30)28-24)16-29(17-23-10-7-13-32-23)26(31)27-18(2)20-8-5-4-6-9-20/h4-15,18H,3,16-17H2,1-2H3,(H,27,31)(H,28,30)