4-[(5Z)-5-(3-methyl-1,3-benzoselenazol-2-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butane-2-sulfonic acid

Systemtic Name: 4-[(5Z)-5-(3-methyl-1,3-benzoselenazol-2-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butane-2-sulfonic acid Openeye Name: 4-[(5Z)-5-(3-methyl-1,3-benzoselenazol-2-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]butane-2-sulfonic acid CAS Name: 4-[(5Z)-5-(3-methyl-1,3-benzoselenazol-2-ylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-butanesulfonic acid IUPAC Name: 4-[(5Z)-5-(3-methyl-1,3-benzoselenazol-2-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butane-2-sulfonic acid Traditional Name: 4-[(5Z)-4-keto-5-(3-methyl-1,3-benzoselenazol-2-ylidene)-2-thioxo-thiazolidin-3-yl]butane-2-sulfonic acid Formula: C15H16N2O4S3Se MolecularWeight: 463.45354

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C(=O)C(=C2N(C3=CC=CC=C3[Se]2)C)SC1=S)S(=O)(=O)O

Isomeric SMILES

CC(CCN1C(=O)/C(=C/2\N(C3=CC=CC=C3[Se]2)C)/SC1=S)S(=O)(=O)O

InChI

InChI=1S/C15H16N2O4S3Se/c1-9(24(19,20)21)7-8-17-13(18)12(23-15(17)22)14-16(2)10-5-3-4-6-11(10)25-14/h3-6,9H,7-8H2,1-2H3,(H,19,20,21)/b14-12-