1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(m-tolyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methylphenyl)-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-3-(m-tolyl)-1-(tetrahydrofurfuryl)thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3CCCO3)C(=S)NC4=CC=CC(=C4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3CCCO3)C(=S)NC4=CC=CC(=C4)C

InChI

InChI=1S/C25H29N3O2S/c1-3-18-9-10-23-19(13-18)14-20(24(29)27-23)15-28(16-22-8-5-11-30-22)25(31)26-21-7-4-6-17(2)12-21/h4,6-7,9-10,12-14,22H,3,5,8,11,15-16H2,1-2H3,(H,26,31)(H,27,29)