1-(2-hydroxyethyl)-3-(3-methoxyphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-(2-hydroxyethyl)-3-(3-methoxyphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-(2-hydroxyethyl)-3-(3-methoxyphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-(2-hydroxyethyl)-3-(3-methoxyphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-(2-hydroxyethyl)-3-(3-methoxyphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-(2-hydroxyethyl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-(3-methoxyphenyl)thiourea Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCO)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCO)C(=S)NC3=CC(=CC=C3)OC

InChI

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