2-[6-azanyl-5-sulfanylidene-4-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)sulfanyl-cyclohexa-1,3-dien-1-yl]butanoic acid

Systemtic Name: 2-[6-azanyl-5-sulfanylidene-4-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)sulfanyl-cyclohexa-1,3-dien-1-yl]butanoic acid Openeye Name: 2-[6-amino-5-thioxo-4-(6-thioxocyclohexa-1,3-dien-1-yl)sulfanyl-cyclohexa-1,3-dien-1-yl]butanoic acid CAS Name: 2-[6-amino-5-sulfanylidene-4-[(6-sulfanylidene-1-cyclohexa-1,3-dienyl)thio]-1-cyclohexa-1,3-dienyl]butanoic acid IUPAC Name: 2-[6-amino-5-sulfanylidene-4-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)sulfanylcyclohexa-1,3-dien-1-yl]butanoic acid Traditional Name: 2-[6-amino-5-thioxo-4-[(6-thioxocyclohexa-1,3-dien-1-yl)thio]cyclohexa-1,3-dien-1-yl]butyric acid Formula: C16H17NO2S3 MolecularWeight: 351.50668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C(=S)C1N)SC2=CC=CCC2=S)C(=O)O

Isomeric SMILES

CCC(C1=CC=C(C(=S)C1N)SC2=CC=CCC2=S)C(=O)O

InChI

InChI=1S/C16H17NO2S3/c1-2-9(16(18)19)10-7-8-13(15(21)14(10)17)22-12-6-4-3-5-11(12)20/h3-4,6-9,14H,2,5,17H2,1H3,(H,18,19)