3-[methyl-[3-(3-methyl-4-pyrrolidin-1-ylcarbonyl-phenyl)prop-2-ynyl]amino]benzenecarboximidamide hydrochloride

Systemtic Name: 3-[methyl-[3-(3-methyl-4-pyrrolidin-1-ylcarbonyl-phenyl)prop-2-ynyl]amino]benzenecarboximidamide hydrochloride Openeye Name: 3-[methyl-[3-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]prop-2-ynyl]amino]benzamidine hydrochloride CAS Name: 3-[methyl-[3-[3-methyl-4-[oxo(1-pyrrolidinyl)methyl]phenyl]prop-2-ynyl]amino]benzenecarboximidamide hydrochloride IUPAC Name: 3-[methyl-[3-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]prop-2-ynyl]amino]benzenecarboximidamide hydrochloride Traditional Name: 3-[methyl-[3-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]prop-2-ynyl]amino]benzamidine hydrochloride Formula: C23H27ClN4O MolecularWeight: 410.93968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#CCN(C)C2=CC=CC(=C2)C(=N)N)C(=O)N3CCCC3.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C#CCN(C)C2=CC=CC(=C2)C(=N)N)C(=O)N3CCCC3.Cl

InChI

InChI=1S/C23H26N4O.ClH/c1-17-15-18(10-11-21(17)23(28)27-13-3-4-14-27)7-6-12-26(2)20-9-5-8-19(16-20)22(24)25;/h5,8-11,15-16H,3-4,12-14H2,1-2H3,(H3,24,25);1H