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

Systemtic Name: 1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(2-thienylmethyl)thiourea CAS Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(2-thenyl)thiourea Formula: C26H27N3O2S2 MolecularWeight: 477.64148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)C(=S)NCCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)C(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2S2/c1-2-31-22-10-11-24-20(16-22)15-21(25(30)28-24)17-29(18-23-9-6-14-33-23)26(32)27-13-12-19-7-4-3-5-8-19/h3-11,14-16H,2,12-13,17-18H2,1H3,(H,27,32)(H,28,30)