(Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)prop-2-enoic acid

Systemtic Name: (Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)prop-2-enoic acid Openeye Name: (Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)prop-2-enoic acid CAS Name: (Z)-2-(1,3-benzoxazol-2-ylthio)-3-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-2-propenoic acid IUPAC Name: (Z)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(1,3-dimethyl-2-oxobenzimidazol-5-yl)prop-2-enoic acid Traditional Name: (Z)-2-(1,3-benzoxazol-2-ylthio)-3-(2-keto-1,3-dimethyl-benzimidazol-5-yl)acrylic acid Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C=C(C(=O)O)SC3=NC4=CC=CC=C4O3)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)/C=C(/C(=O)O)\SC3=NC4=CC=CC=C4O3)N(C1=O)C

InChI

InChI=1S/C19H15N3O4S/c1-21-13-8-7-11(9-14(13)22(2)19(21)25)10-16(17(23)24)27-18-20-12-5-3-4-6-15(12)26-18/h3-10H,1-2H3,(H,23,24)/b16-10-