N-[(3-carbamimidoylphenyl)methyl]-3-methyl-4-pyrrolidin-1-ylcarbonyl-benzamide

Systemtic Name: N-[(3-carbamimidoylphenyl)methyl]-3-methyl-4-pyrrolidin-1-ylcarbonyl-benzamide Openeye Name: N-[(3-carbamimidoylphenyl)methyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide CAS Name: N-[(3-carbamimidoylphenyl)methyl]-3-methyl-4-[oxo(1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-[(3-carbamimidoylphenyl)methyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Traditional Name: N-(3-amidinobenzyl)-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC=CC(=C2)C(=N)N)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC=CC(=C2)C(=N)N)C(=O)N3CCCC3

InChI

InChI=1S/C21H24N4O2/c1-14-11-17(7-8-18(14)21(27)25-9-2-3-10-25)20(26)24-13-15-5-4-6-16(12-15)19(22)23/h4-8,11-12H,2-3,9-10,13H2,1H3,(H3,22,23)(H,24,26)