4-[[bis(azanyl)methylideneamino]methyl]-N-pyridin-4-yl-benzamide hydrate hydrochloride

Systemtic Name: 4-[[bis(azanyl)methylideneamino]methyl]-N-pyridin-4-yl-benzamide hydrate hydrochloride Openeye Name: 4-(guanidinomethyl)-N-(4-pyridyl)benzamide hydrate hydrochloride CAS Name: 4-[(diaminomethylideneamino)methyl]-N-pyridin-4-ylbenzamide hydrate hydrochloride IUPAC Name: 4-[(diaminomethylideneamino)methyl]-N-pyridin-4-ylbenzamide hydrate hydrochloride Traditional Name: 4-(guanidinomethyl)-N-(4-pyridyl)benzamide hydrate hydrochloride Formula: C14H18ClN5O2 MolecularWeight: 323.77802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN=C(N)N)C(=O)NC2=CC=NC=C2.O.Cl

Isomeric SMILES

C1=CC(=CC=C1CN=C(N)N)C(=O)NC2=CC=NC=C2.O.Cl

InChI

InChI=1S/C14H15N5O.ClH.H2O/c15-14(16)18-9-10-1-3-11(4-2-10)13(20)19-12-5-7-17-8-6-12;;/h1-8H,9H2,(H4,15,16,18)(H,17,19,20);1H;1H2