3-(2-ethylphenyl)-1-(furan-2-ylmethyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-(furan-2-ylmethyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-(2-ethylphenyl)-1-(2-furylmethyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(2-ethylphenyl)-1-(2-furanylmethyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-(2-ethylphenyl)-1-(furan-2-ylmethyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-(2-ethylphenyl)-1-(2-furfuryl)-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C25H25N3O3S MolecularWeight: 447.5493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C=C(C=C4)OC)NC3=O

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C=C(C=C4)OC)NC3=O

InChI

InChI=1S/C25H25N3O3S/c1-3-17-7-4-5-9-22(17)27-25(32)28(16-21-8-6-12-31-21)15-19-13-18-10-11-20(30-2)14-23(18)26-24(19)29/h4-14H,3,15-16H2,1-2H3,(H,26,29)(H,27,32)