1-cyclopentyl-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-cyclopentyl-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-cyclopentyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-cyclopentyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(C3CCCC3)C(=S)NC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(C3CCCC3)C(=S)NC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C25H29N3O2S/c1-16-12-17(2)22-14-18(24(29)27-23(22)13-16)15-28(20-6-4-5-7-20)25(31)26-19-8-10-21(30-3)11-9-19/h8-14,20H,4-7,15H2,1-3H3,(H,26,31)(H,27,29)