N-[1-(5-carbamimidoyl-2-phenylmethoxy-phenyl)-2-pyridin-3-yl-ethyl]-3-methyl-4-pyrrolidin-1-ylcarbonyl-benzamide

Systemtic Name: N-[1-(5-carbamimidoyl-2-phenylmethoxy-phenyl)-2-pyridin-3-yl-ethyl]-3-methyl-4-pyrrolidin-1-ylcarbonyl-benzamide Openeye Name: N-[1-(2-benzyloxy-5-carbamimidoyl-phenyl)-2-(3-pyridyl)ethyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide CAS Name: N-[1-(5-carbamimidoyl-2-phenylmethoxyphenyl)-2-(3-pyridinyl)ethyl]-3-methyl-4-[oxo(1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-[1-(5-carbamimidoyl-2-phenylmethoxyphenyl)-2-pyridin-3-ylethyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Traditional Name: N-[1-(5-amidino-2-benzoxy-phenyl)-2-(3-pyridyl)ethyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Formula: C34H35N5O3 MolecularWeight: 561.6734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(CC2=CN=CC=C2)C3=C(C=CC(=C3)C(=N)N)OCC4=CC=CC=C4)C(=O)N5CCCC5

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC(CC2=CN=CC=C2)C3=C(C=CC(=C3)C(=N)N)OCC4=CC=CC=C4)C(=O)N5CCCC5

InChI

InChI=1S/C34H35N5O3/c1-23-18-27(11-13-28(23)34(41)39-16-5-6-17-39)33(40)38-30(19-25-10-7-15-37-21-25)29-20-26(32(35)36)12-14-31(29)42-22-24-8-3-2-4-9-24/h2-4,7-15,18,20-21,30H,5-6,16-17,19,22H2,1H3,(H3,35,36)(H,38,40)