1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)-1-(phenylmethyl)thiourea

Systemtic Name: 1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-isobutyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methylpropyl)thiourea Traditional Name: 1-benzyl-3-isobutyl-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NCC(C)C

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NCC(C)C

InChI

InChI=1S/C23H27N3OS/c1-16(2)13-24-23(28)26(14-18-9-5-4-6-10-18)15-20-12-19-11-7-8-17(3)21(19)25-22(20)27/h4-12,16H,13-15H2,1-3H3,(H,24,28)(H,25,27)