3-(3-chlorophenyl)-1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 3-(3-chlorophenyl)-1-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(3-chlorophenyl)-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(3-chlorophenyl)-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(3-chlorophenyl)-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(3-chlorophenyl)-1-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-1-(tetrahydrofurfuryl)thiourea Formula: C24H26ClN3O2S MolecularWeight: 456.00014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3CCCO3)C(=S)NC4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3CCCO3)C(=S)NC4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C24H26ClN3O2S/c1-15-9-17-11-18(23(29)27-22(17)10-16(15)2)13-28(14-21-7-4-8-30-21)24(31)26-20-6-3-5-19(25)12-20/h3,5-6,9-12,21H,4,7-8,13-14H2,1-2H3,(H,26,31)(H,27,29)