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

Systemtic Name: N-[1-(3-carbamimidoylphenyl)-3-(ethylamino)-3-oxidanylidene-propyl]-3-methyl-4-pyrrolidin-1-ylcarbonyl-benzamide Openeye Name: N-[1-(3-carbamimidoylphenyl)-3-(ethylamino)-3-oxo-propyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide CAS Name: N-[1-(3-carbamimidoylphenyl)-3-(ethylamino)-3-oxopropyl]-3-methyl-4-[oxo(1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-[1-(3-carbamimidoylphenyl)-3-(ethylamino)-3-oxopropyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Traditional Name: N-[1-(3-amidinophenyl)-3-(ethylamino)-3-keto-propyl]-3-methyl-4-(pyrrolidine-1-carbonyl)benzamide Formula: C25H31N5O3 MolecularWeight: 449.54534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N5O3/c1-3-28-22(31)15-21(17-7-6-8-18(14-17)23(26)27)29-24(32)19-9-10-20(16(2)13-19)25(33)30-11-4-5-12-30/h6-10,13-14,21H,3-5,11-12,15H2,1-2H3,(H3,26,27)(H,28,31)(H,29,32)