2-ethanoyl-4-methyl-3-(piperidin-4-ylamino)-1-pyrimidin-2-yl-pyrrolidine-2-carbonitrile

Systemtic Name: 2-ethanoyl-4-methyl-3-(piperidin-4-ylamino)-1-pyrimidin-2-yl-pyrrolidine-2-carbonitrile Openeye Name: 2-acetyl-4-methyl-3-(4-piperidylamino)-1-pyrimidin-2-yl-pyrrolidine-2-carbonitrile CAS Name: 2-acetyl-4-methyl-3-(4-piperidinylamino)-1-(2-pyrimidinyl)-2-pyrrolidinecarbonitrile IUPAC Name: 2-acetyl-4-methyl-3-(piperidin-4-ylamino)-1-pyrimidin-2-ylpyrrolidine-2-carbonitrile Traditional Name: 2-acetyl-4-methyl-3-(4-piperidylamino)-1-(2-pyrimidyl)pyrrolidine-2-carbonitrile Formula: C17H24N6O MolecularWeight: 328.41206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(C1NC2CCNCC2)(C#N)C(=O)C)C3=NC=CC=N3

Isomeric SMILES

CC1CN(C(C1NC2CCNCC2)(C#N)C(=O)C)C3=NC=CC=N3

InChI

InChI=1S/C17H24N6O/c1-12-10-23(16-20-6-3-7-21-16)17(11-18,13(2)24)15(12)22-14-4-8-19-9-5-14/h3,6-7,12,14-15,19,22H,4-5,8-10H2,1-2H3