4-[(5Z)-4-oxidanylidene-5-(2-oxidanylidene-1-propyl-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[(5Z)-4-oxidanylidene-5-(2-oxidanylidene-1-propyl-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[(5Z)-4-oxo-5-(2-oxo-1-propyl-indolin-3-ylidene)-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[(5Z)-4-oxo-5-(2-oxo-1-propyl-3-indolylidene)-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[(5Z)-4-oxo-5-(2-oxo-1-propylindol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[(5Z)-4-keto-5-(2-keto-1-propyl-indolin-3-ylidene)-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=C3C(=O)N(C(=S)S3)CCCC(=O)O)C1=O

Isomeric SMILES

CCCN1C2=CC=CC=C2/C(=C/3\C(=O)N(C(=S)S3)CCCC(=O)O)/C1=O

InChI

InChI=1S/C18H18N2O4S2/c1-2-9-19-12-7-4-3-6-11(12)14(16(19)23)15-17(24)20(18(25)26-15)10-5-8-13(21)22/h3-4,6-7H,2,5,8-10H2,1H3,(H,21,22)/b15-14-