N-[1-(6-azanyl-2-azanylidene-1-oxidanyl-pyrimidin-4-yl)piperidin-4-yl]benzamide hydrochloride

Systemtic Name: N-[1-(6-azanyl-2-azanylidene-1-oxidanyl-pyrimidin-4-yl)piperidin-4-yl]benzamide hydrochloride Openeye Name: N-[1-(6-amino-1-hydroxy-2-imino-pyrimidin-4-yl)-4-piperidyl]benzamide hydrochloride CAS Name: N-[1-(6-amino-1-hydroxy-2-imino-4-pyrimidinyl)-4-piperidinyl]benzamide hydrochloride IUPAC Name: N-[1-(6-amino-1-hydroxy-2-iminopyrimidin-4-yl)piperidin-4-yl]benzamide hydrochloride Traditional Name: N-[1-(6-amino-1-hydroxy-2-imino-pyrimidin-4-yl)-4-piperidyl]benzamide hydrochloride Formula: C16H21ClN6O2 MolecularWeight: 364.82994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=CC=C2)C3=NC(=N)N(C(=C3)N)O.Cl

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=CC=C2)C3=NC(=N)N(C(=C3)N)O.Cl

InChI

InChI=1S/C16H20N6O2.ClH/c17-13-10-14(20-16(18)22(13)24)21-8-6-12(7-9-21)19-15(23)11-4-2-1-3-5-11;/h1-5,10,12,18,24H,6-9,17H2,(H,19,23);1H