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

Systemtic Name: 3-(3-chlorophenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-(3-chlorophenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(3-chlorophenyl)-1-[(1-ethyl-2-pyrrolidinyl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-(3-chlorophenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-(3-chlorophenyl)-1-[(1-ethylpyrrolidin-2-yl)methyl]-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C25H29ClN4OS MolecularWeight: 469.04196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CN(CC2=CC3=C(C=C(C=C3)C)NC2=O)C(=S)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CCN1CCCC1CN(CC2=CC3=C(C=C(C=C3)C)NC2=O)C(=S)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H29ClN4OS/c1-3-29-11-5-8-22(29)16-30(25(32)27-21-7-4-6-20(26)14-21)15-19-13-18-10-9-17(2)12-23(18)28-24(19)31/h4,6-7,9-10,12-14,22H,3,5,8,11,15-16H2,1-2H3,(H,27,32)(H,28,31)