2-[3-(4-pyrrolidin-1-ylcarbonylphenyl)prop-2-ynylamino]benzenecarboximidamide

Systemtic Name: 2-[3-(4-pyrrolidin-1-ylcarbonylphenyl)prop-2-ynylamino]benzenecarboximidamide Openeye Name: 2-[3-[4-(pyrrolidine-1-carbonyl)phenyl]prop-2-ynylamino]benzamidine CAS Name: 2-[3-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]prop-2-ynylamino]benzenecarboximidamide IUPAC Name: 2-[3-[4-(pyrrolidine-1-carbonyl)phenyl]prop-2-ynylamino]benzenecarboximidamide Traditional Name: 2-[3-[4-(pyrrolidine-1-carbonyl)phenyl]prop-2-ynylamino]benzamidine Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)C#CCNC3=CC=CC=C3C(=N)N

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)C#CCNC3=CC=CC=C3C(=N)N

InChI

InChI=1S/C21H22N4O/c22-20(23)18-7-1-2-8-19(18)24-13-5-6-16-9-11-17(12-10-16)21(26)25-14-3-4-15-25/h1-2,7-12,24H,3-4,13-15H2,(H3,22,23)