2-azanyl-4-[(phenylmethyl)amino]-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[(phenylmethyl)amino]-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-(benzylamino)-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[(phenylmethyl)amino]-6-(1-pyrrolidinyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-(benzylamino)-6-pyrrolidin-1-ylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-(benzylamino)-6-pyrrolidino-pyrimidine-5-carbonitrile Formula: C16H18N6 MolecularWeight: 294.35432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC(=N2)N)NCC3=CC=CC=C3)C#N

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC(=N2)N)NCC3=CC=CC=C3)C#N

InChI

InChI=1S/C16H18N6/c17-10-13-14(19-11-12-6-2-1-3-7-12)20-16(18)21-15(13)22-8-4-5-9-22/h1-3,6-7H,4-5,8-9,11H2,(H3,18,19,20,21)