methyl 3-[(5Z)-5-(1-heptyl-2-oxidanylidene-indol-3-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: methyl 3-[(5Z)-5-(1-heptyl-2-oxidanylidene-indol-3-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: methyl 3-[(5Z)-5-(1-heptyl-2-oxo-indolin-3-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5Z)-5-(1-heptyl-2-oxo-3-indolylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(5Z)-5-(1-heptyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5Z)-5-(1-heptyl-2-keto-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid methyl ester Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2C(=C3C(=O)N(C(=S)S3)CCC(=O)OC)C1=O

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2/C(=C/3\C(=O)N(C(=S)S3)CCC(=O)OC)/C1=O

InChI

InChI=1S/C22H26N2O4S2/c1-3-4-5-6-9-13-23-16-11-8-7-10-15(16)18(20(23)26)19-21(27)24(22(29)30-19)14-12-17(25)28-2/h7-8,10-11H,3-6,9,12-14H2,1-2H3/b19-18-