N-[bis(azanyl)methylidene]-4-butyl-3-(2-cyanopyrrol-1-yl)benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-butyl-3-(2-cyanopyrrol-1-yl)benzamide hydrochloride Openeye Name: 4-butyl-3-(2-cyanopyrrol-1-yl)-N-(diaminomethylene)benzamide hydrochloride CAS Name: 4-butyl-3-(2-cyano-1-pyrrolyl)-N-(diaminomethylidene)benzamide hydrochloride IUPAC Name: 4-butyl-3-(2-cyanopyrrol-1-yl)-N-(diaminomethylidene)benzamide hydrochloride Traditional Name: 4-butyl-3-(2-cyanopyrrol-1-yl)-N-(diaminomethylene)benzamide hydrochloride Formula: C17H20ClN5O MolecularWeight: 345.8266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(=O)N=C(N)N)N2C=CC=C2C#N.Cl

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(=O)N=C(N)N)N2C=CC=C2C#N.Cl

InChI

InChI=1S/C17H19N5O.ClH/c1-2-3-5-12-7-8-13(16(23)21-17(19)20)10-15(12)22-9-4-6-14(22)11-18;/h4,6-10H,2-3,5H2,1H3,(H4,19,20,21,23);1H