1-(2-hydroxyethyl)-3-(4-methoxyphenyl)-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-(2-hydroxyethyl)-3-(4-methoxyphenyl)-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-(2-hydroxyethyl)-3-(4-methoxyphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-(2-hydroxyethyl)-3-(4-methoxyphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-(2-hydroxyethyl)-3-(4-methoxyphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-(2-hydroxyethyl)-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCO)C(=S)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCO)C(=S)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N3O3S/c1-14-3-4-15-12-16(20(26)23-19(15)11-14)13-24(9-10-25)21(28)22-17-5-7-18(27-2)8-6-17/h3-8,11-12,25H,9-10,13H2,1-2H3,(H,22,28)(H,23,26)