N-[bis(azanyl)methylidene]-4-butyl-3-pyrrol-1-yl-benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-butyl-3-pyrrol-1-yl-benzamide hydrochloride Openeye Name: 4-butyl-N-(diaminomethylene)-3-pyrrol-1-yl-benzamide hydrochloride CAS Name: 4-butyl-N-(diaminomethylidene)-3-(1-pyrrolyl)benzamide hydrochloride IUPAC Name: 4-butyl-N-(diaminomethylidene)-3-pyrrol-1-ylbenzamide hydrochloride Traditional Name: 4-butyl-N-(diaminomethylene)-3-pyrrol-1-yl-benzamide hydrochloride Formula: C16H21ClN4O MolecularWeight: 320.81714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(=O)N=C(N)N)N2C=CC=C2.Cl

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(=O)N=C(N)N)N2C=CC=C2.Cl

InChI

InChI=1S/C16H20N4O.ClH/c1-2-3-6-12-7-8-13(15(21)19-16(17)18)11-14(12)20-9-4-5-10-20;/h4-5,7-11H,2-3,6H2,1H3,(H4,17,18,19,21);1H