5-azanyl-2-[[2-benzamido-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[[2-benzamido-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[2-benzamido-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enoyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-benzamido-1-oxo-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]prop-2-enyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-benzamido-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enoyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[[2-benzamido-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acryloyl]amino]-5-keto-valeric acid Formula: C29H26N6O5 MolecularWeight: 538.55394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C29H26N6O5/c30-25(36)14-13-23(29(39)40)32-28(38)24(33-27(37)19-8-3-1-4-9-19)16-21-18-35(22-11-5-2-6-12-22)34-26(21)20-10-7-15-31-17-20/h1-12,15-18,23H,13-14H2,(H2,30,36)(H,32,38)(H,33,37)(H,39,40)