ethyl 4-[2-[2-(1,3-benzothiazol-2-ylimino)-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[2-(1,3-benzothiazol-2-ylimino)-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-allyl-2-(1,3-benzothiazol-2-ylimino)-4-oxo-thiazolidin-5-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[2-(1,3-benzothiazol-2-ylimino)-4-oxo-3-prop-2-enyl-5-thiazolidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[2-(1,3-benzothiazol-2-ylimino)-4-oxo-3-prop-2-enyl-1,3-thiazolidin-5-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[3-allyl-2-(1,3-benzothiazol-2-ylimino)-4-keto-thiazolidin-5-yl]acetyl]amino]benzoic acid ethyl ester Formula: C24H22N4O4S2 MolecularWeight: 494.58588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=NC3=NC4=CC=CC=C4S3)S2)CC=C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=NC3=NC4=CC=CC=C4S3)S2)CC=C

InChI

InChI=1S/C24H22N4O4S2/c1-3-13-28-21(30)19(34-24(28)27-23-26-17-7-5-6-8-18(17)33-23)14-20(29)25-16-11-9-15(10-12-16)22(31)32-4-2/h3,5-12,19H,1,4,13-14H2,2H3,(H,25,29)