1-cyclopentyl-1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NC4=CC(=CC=C4)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NC4=CC(=CC=C4)OC)C

InChI

InChI=1S/C25H29N3O2S/c1-16-11-18-13-19(24(29)27-23(18)12-17(16)2)15-28(21-8-4-5-9-21)25(31)26-20-7-6-10-22(14-20)30-3/h6-7,10-14,21H,4-5,8-9,15H2,1-3H3,(H,26,31)(H,27,29)