3-(4-ethylphenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 3-(4-ethylphenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-(4-ethylphenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(4-ethylphenyl)-1-[(1-ethyl-2-pyrrolidinyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-(4-ethylphenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-(4-ethylphenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C27H34N4OS MolecularWeight: 462.65006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N(CC2CCCN2CC)CC3=CC4=C(C=C(C=C4)C)NC3=O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N(CC2CCCN2CC)CC3=CC4=C(C=C(C=C4)C)NC3=O

InChI

InChI=1S/C27H34N4OS/c1-4-20-9-12-23(13-10-20)28-27(33)31(18-24-7-6-14-30(24)5-2)17-22-16-21-11-8-19(3)15-25(21)29-26(22)32/h8-13,15-16,24H,4-7,14,17-18H2,1-3H3,(H,28,33)(H,29,32)