4-acetamido-5-[[3-[(4-carbamimidoylphenyl)carbamoyl]-1,5-diphenyl-pyrazol-4-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-acetamido-5-[[3-[(4-carbamimidoylphenyl)carbamoyl]-1,5-diphenyl-pyrazol-4-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-acetamido-5-[[3-[(4-carbamimidoylphenyl)carbamoyl]-1,5-diphenyl-pyrazol-4-yl]amino]-5-oxo-pentanoic acid CAS Name: 4-acetamido-5-[[3-[(4-carbamimidoylanilino)-oxomethyl]-1,5-diphenyl-4-pyrazolyl]amino]-5-oxopentanoic acid IUPAC Name: 4-acetamido-5-[[3-[(4-carbamimidoylphenyl)carbamoyl]-1,5-diphenylpyrazol-4-yl]amino]-5-oxopentanoic acid Traditional Name: 4-acetamido-5-[[3-[(4-amidinophenyl)carbamoyl]-1,5-diphenyl-pyrazol-4-yl]amino]-5-keto-valeric acid Formula: C30H29N7O5 MolecularWeight: 567.59516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)O)C(=O)NC1=C(N(N=C1C(=O)NC2=CC=C(C=C2)C(=N)N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC(CCC(=O)O)C(=O)NC1=C(N(N=C1C(=O)NC2=CC=C(C=C2)C(=N)N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H29N7O5/c1-18(38)33-23(16-17-24(39)40)29(41)35-25-26(30(42)34-21-14-12-20(13-15-21)28(31)32)36-37(22-10-6-3-7-11-22)27(25)19-8-4-2-5-9-19/h2-15,23H,16-17H2,1H3,(H3,31,32)(H,33,38)(H,34,42)(H,35,41)(H,39,40)