5-[5-[2,6-bis(chloranyl)phenyl]sulfanyl-1,2,3,4-tetrazol-2-yl]-3-[2-(4-hydroxyphenyl)ethoxycarbonylamino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-[5-[2,6-bis(chloranyl)phenyl]sulfanyl-1,2,3,4-tetrazol-2-yl]-3-[2-(4-hydroxyphenyl)ethoxycarbonylamino]-4-oxidanylidene-pentanoic acid Openeye Name: 5-[5-(2,6-dichlorophenyl)sulfanyltetrazol-2-yl]-3-[2-(4-hydroxyphenyl)ethoxycarbonylamino]-4-oxo-pentanoic acid CAS Name: 5-[5-[(2,6-dichlorophenyl)thio]-2-tetrazolyl]-3-[[2-(4-hydroxyphenyl)ethoxy-oxomethyl]amino]-4-oxopentanoic acid IUPAC Name: 5-[5-(2,6-dichlorophenyl)sulfanyltetrazol-2-yl]-3-[2-(4-hydroxyphenyl)ethoxycarbonylamino]-4-oxopentanoic acid Traditional Name: 5-[5-[(2,6-dichlorophenyl)thio]tetrazol-2-yl]-3-[2-(4-hydroxyphenyl)ethoxycarbonylamino]-4-keto-valeric acid Formula: C21H19Cl2N5O6S MolecularWeight: 540.37646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)SC2=NN(N=N2)CC(=O)C(CC(=O)O)NC(=O)OCCC3=CC=C(C=C3)O)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)SC2=NN(N=N2)CC(=O)C(CC(=O)O)NC(=O)OCCC3=CC=C(C=C3)O)Cl

InChI

InChI=1S/C21H19Cl2N5O6S/c22-14-2-1-3-15(23)19(14)35-20-25-27-28(26-20)11-17(30)16(10-18(31)32)24-21(33)34-9-8-12-4-6-13(29)7-5-12/h1-7,16,29H,8-11H2,(H,24,33)(H,31,32)