1-(3,5-dimethylphenyl)-3-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[2-(2-keto-7-methoxy-1H-quinolin-3-yl)ethyl]thiourea Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NCCC2=CC3=C(C=C(C=C3)OC)NC2=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NCCC2=CC3=C(C=C(C=C3)OC)NC2=O)C

InChI

InChI=1S/C21H23N3O2S/c1-13-8-14(2)10-17(9-13)23-21(27)22-7-6-16-11-15-4-5-18(26-3)12-19(15)24-20(16)25/h4-5,8-12H,6-7H2,1-3H3,(H,24,25)(H2,22,23,27)