1-[(3-cyanophenyl)amino]-3-[3-methyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]urea

Systemtic Name: 1-[(3-cyanophenyl)amino]-3-[3-methyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]urea Openeye Name: 1-(3-cyanoanilino)-3-[3-methyl-4-(2-oxo-1-piperidyl)phenyl]urea CAS Name: 1-(3-cyanoanilino)-3-[3-methyl-4-(2-oxo-1-piperidinyl)phenyl]urea IUPAC Name: 1-(3-cyanoanilino)-3-[3-methyl-4-(2-oxopiperidin-1-yl)phenyl]urea Traditional Name: 1-(3-cyanoanilino)-3-[4-(2-ketopiperidino)-3-methyl-phenyl]urea Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)NNC2=CC=CC(=C2)C#N)N3CCCCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)NNC2=CC=CC(=C2)C#N)N3CCCCC3=O

InChI

InChI=1S/C20H21N5O2/c1-14-11-16(8-9-18(14)25-10-3-2-7-19(25)26)22-20(27)24-23-17-6-4-5-15(12-17)13-21/h4-6,8-9,11-12,23H,2-3,7,10H2,1H3,(H2,22,24,27)