5-(5-naphthalen-1-ylsulfanyl-1,2,3,4-tetrazol-1-yl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5-(5-naphthalen-1-ylsulfanyl-1,2,3,4-tetrazol-1-yl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-5-[5-(1-naphthylsulfanyl)tetrazol-1-yl]-4-oxo-pentanoic acid CAS Name: 5-[5-(1-naphthalenylthio)-1-tetrazolyl]-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5-(5-naphthalen-1-ylsulfanyltetrazol-1-yl)-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-4-keto-5-[5-(1-naphthylthio)tetrazol-1-yl]valeric acid Formula: C24H21N5O5S MolecularWeight: 491.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)CN2C(=NN=N2)SC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)CN2C(=NN=N2)SC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H21N5O5S/c30-20(19(13-22(31)32)25-24(33)34-15-16-7-2-1-3-8-16)14-29-23(26-27-28-29)35-21-12-6-10-17-9-4-5-11-18(17)21/h1-12,19H,13-15H2,(H,25,33)(H,31,32)