5-[1-azanyl-4-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-5-phenyl-pentan-2-yl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 5-[1-azanyl-4-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-5-phenyl-pentan-2-yl]-1,3-thiazole-4-carboxylic acid Openeye Name: 5-[1-(aminomethyl)-3-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-4-phenyl-butyl]thiazole-4-carboxylic acid CAS Name: 5-[1-amino-4-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-oxo-5-phenylpentan-2-yl]-4-thiazolecarboxylic acid IUPAC Name: 5-[1-amino-4-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-oxo-5-phenylpentan-2-yl]-1,3-thiazole-4-carboxylic acid Traditional Name: 5-[1-(aminomethyl)-3-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]amino]-2-keto-4-phenyl-butyl]thiazole-4-carboxylic acid Formula: C26H26N4O5S MolecularWeight: 506.57344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)C(CN)C2=C(N=CS2)C(=O)O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)C(CN)C2=C(N=CS2)C(=O)O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C26H26N4O5S/c27-12-18(24-22(26(34)35)29-14-36-24)23(31)20(10-15-6-2-1-3-7-15)30-21(25(32)33)11-16-13-28-19-9-5-4-8-17(16)19/h1-9,13-14,18,20-21,28,30H,10-12,27H2,(H,32,33)(H,34,35)