1-[2-[(3-cyano-8-methyl-quinolin-2-yl)amino]ethyl]-3-(2,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-[2-[(3-cyano-8-methyl-quinolin-2-yl)amino]ethyl]-3-(2,4-dimethoxyphenyl)thiourea Openeye Name: 1-[2-[(3-cyano-8-methyl-2-quinolyl)amino]ethyl]-3-(2,4-dimethoxyphenyl)thiourea CAS Name: 1-[2-[(3-cyano-8-methyl-2-quinolinyl)amino]ethyl]-3-(2,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[2-[(3-cyano-8-methylquinolin-2-yl)amino]ethyl]-3-(2,4-dimethoxyphenyl)thiourea Traditional Name: 1-[2-[(3-cyano-8-methyl-2-quinolyl)amino]ethyl]-3-(2,4-dimethoxyphenyl)thiourea Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C(=C2)C#N)NCCNC(=S)NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC2=C1N=C(C(=C2)C#N)NCCNC(=S)NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C22H23N5O2S/c1-14-5-4-6-15-11-16(13-23)21(27-20(14)15)24-9-10-25-22(30)26-18-8-7-17(28-2)12-19(18)29-3/h4-8,11-12H,9-10H2,1-3H3,(H,24,27)(H2,25,26,30)