1-[4-[(3-methylphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]piperidine-4-carboxamide

Systemtic Name: 1-[4-[(3-methylphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]piperidine-4-carboxamide Openeye Name: 1-[4-(3-methylanilino)pyrimido[5,4-d]pyrimidin-6-yl]piperidine-4-carboxamide CAS Name: 1-[4-(3-methylanilino)-6-pyrimido[5,4-d]pyrimidinyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-(3-methylanilino)pyrimido[5,4-d]pyrimidin-6-yl]piperidine-4-carboxamide Traditional Name: 1-[4-(m-toluidino)pyrimido[5,4-d]pyrimidin-6-yl]isonipecotamide Formula: C19H21N7O MolecularWeight: 363.41634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C19H21N7O/c1-12-3-2-4-14(9-12)24-18-16-15(22-11-23-18)10-21-19(25-16)26-7-5-13(6-8-26)17(20)27/h2-4,9-11,13H,5-8H2,1H3,(H2,20,27)(H,22,23,24)