2-azanyl-2-(3-carbamimidoylphenyl)-N-(3-methyl-4-pyrrolidin-1-ylcarbonyl-phenyl)ethanamide

Systemtic Name: 2-azanyl-2-(3-carbamimidoylphenyl)-N-(3-methyl-4-pyrrolidin-1-ylcarbonyl-phenyl)ethanamide Openeye Name: 2-amino-2-(3-carbamimidoylphenyl)-N-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-amino-2-(3-carbamimidoylphenyl)-N-[3-methyl-4-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-amino-2-(3-carbamimidoylphenyl)-N-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-(3-amidinophenyl)-2-amino-N-[3-methyl-4-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(C2=CC=CC(=C2)C(=N)N)N)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(C2=CC=CC(=C2)C(=N)N)N)C(=O)N3CCCC3

InChI

InChI=1S/C21H25N5O2/c1-13-11-16(7-8-17(13)21(28)26-9-2-3-10-26)25-20(27)18(22)14-5-4-6-15(12-14)19(23)24/h4-8,11-12,18H,2-3,9-10,22H2,1H3,(H3,23,24)(H,25,27)