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

Systemtic Name: 1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(2-thienylmethyl)thiourea CAS Name: 1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-3-phenethyl-1-(2-thenyl)thiourea Formula: C25H25N3OS2 MolecularWeight: 447.6155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CS3)C(=S)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CS3)C(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3OS2/c1-18-9-10-20-15-21(24(29)27-23(20)14-18)16-28(17-22-8-5-13-31-22)25(30)26-12-11-19-6-3-2-4-7-19/h2-10,13-15H,11-12,16-17H2,1H3,(H,26,30)(H,27,29)