1-[4-[(3-methylphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-[4-[(3-methylphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]pyrrolidine-2-carboxamide Openeye Name: 1-[4-(3-methylanilino)pyrimido[5,4-d]pyrimidin-6-yl]pyrrolidine-2-carboxamide CAS Name: 1-[4-(3-methylanilino)-6-pyrimido[5,4-d]pyrimidinyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[4-(3-methylanilino)pyrimido[5,4-d]pyrimidin-6-yl]pyrrolidine-2-carboxamide Traditional Name: 1-[4-(m-toluidino)pyrimido[5,4-d]pyrimidin-6-yl]pyrrolidine-2-carboxamide Formula: C18H19N7O MolecularWeight: 349.38976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)N4CCCC4C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)N4CCCC4C(=O)N

InChI

InChI=1S/C18H19N7O/c1-11-4-2-5-12(8-11)23-17-15-13(21-10-22-17)9-20-18(24-15)25-7-3-6-14(25)16(19)26/h2,4-5,8-10,14H,3,6-7H2,1H3,(H2,19,26)(H,21,22,23)