1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(3-oxidanylpropyl)thiourea

Systemtic Name: 1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(3-oxidanylpropyl)thiourea Openeye Name: 1-(3-hydroxypropyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(m-tolyl)thiourea CAS Name: 1-(3-hydroxypropyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)thiourea IUPAC Name: 1-(3-hydroxypropyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)thiourea Traditional Name: 1-(3-hydroxypropyl)-1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-3-(m-tolyl)thiourea Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CCCO)CC2=CC3=C(C=CC(=C3)OC)NC2=O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CCCO)CC2=CC3=C(C=CC(=C3)OC)NC2=O

InChI

InChI=1S/C22H25N3O3S/c1-15-5-3-6-18(11-15)23-22(29)25(9-4-10-26)14-17-12-16-13-19(28-2)7-8-20(16)24-21(17)27/h3,5-8,11-13,26H,4,9-10,14H2,1-2H3,(H,23,29)(H,24,27)