4-(4-azanylpiperidin-1-yl)-6-[(4-chlorophenyl)amino]pyrimidine-2-carbonitrile

Systemtic Name: 4-(4-azanylpiperidin-1-yl)-6-[(4-chlorophenyl)amino]pyrimidine-2-carbonitrile Openeye Name: 4-(4-amino-1-piperidyl)-6-(4-chloroanilino)pyrimidine-2-carbonitrile CAS Name: 4-(4-amino-1-piperidinyl)-6-(4-chloroanilino)-2-pyrimidinecarbonitrile IUPAC Name: 4-(4-aminopiperidin-1-yl)-6-(4-chloroanilino)pyrimidine-2-carbonitrile Traditional Name: 4-(4-aminopiperidino)-6-(4-chloroanilino)pyrimidine-2-carbonitrile Formula: C16H17ClN6 MolecularWeight: 328.79938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)C2=CC(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1N)C2=CC(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H17ClN6/c17-11-1-3-13(4-2-11)20-14-9-16(22-15(10-18)21-14)23-7-5-12(19)6-8-23/h1-4,9,12H,5-8,19H2,(H,20,21,22)