1-[2-[(3-cyano-6-ethyl-quinolin-2-yl)amino]ethyl]-3-(4-methylsulfanylphenyl)urea

Systemtic Name: 1-[2-[(3-cyano-6-ethyl-quinolin-2-yl)amino]ethyl]-3-(4-methylsulfanylphenyl)urea Openeye Name: 1-[2-[(3-cyano-6-ethyl-2-quinolyl)amino]ethyl]-3-(4-methylsulfanylphenyl)urea CAS Name: 1-[2-[(3-cyano-6-ethyl-2-quinolinyl)amino]ethyl]-3-[4-(methylthio)phenyl]urea IUPAC Name: 1-[2-[(3-cyano-6-ethylquinolin-2-yl)amino]ethyl]-3-(4-methylsulfanylphenyl)urea Traditional Name: 1-[2-[(3-cyano-6-ethyl-2-quinolyl)amino]ethyl]-3-[4-(methylthio)phenyl]urea Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)NCCNC(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)NCCNC(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C22H23N5OS/c1-3-15-4-9-20-16(12-15)13-17(14-23)21(27-20)24-10-11-25-22(28)26-18-5-7-19(29-2)8-6-18/h4-9,12-13H,3,10-11H2,1-2H3,(H,24,27)(H2,25,26,28)