1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(4-methoxyphenyl)urea Openeye Name: 1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(4-methoxyphenyl)urea CAS Name: 1-[(2-cyano-4-pyrimidinyl)-(2,2-dimethylpropyl)amino]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(4-methoxyphenyl)urea Traditional Name: 1-[(2-cyanopyrimidin-4-yl)-neopentyl-amino]-3-(4-methoxyphenyl)urea Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN(C1=NC(=NC=C1)C#N)NC(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)CN(C1=NC(=NC=C1)C#N)NC(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H22N6O2/c1-18(2,3)12-24(16-9-10-20-15(11-19)22-16)23-17(25)21-13-5-7-14(26-4)8-6-13/h5-10H,12H2,1-4H3,(H2,21,23,25)