4-[(2,5-dimethylpyrazol-3-yl)methyl]-6-[(Z)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[(2,5-dimethylpyrazol-3-yl)methyl]-6-[(Z)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[(2,5-dimethylpyrazol-3-yl)methyl]-6-[(Z)-(4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one CAS Name: 4-[(2,5-dimethyl-3-pyrazolyl)methyl]-6-[(Z)-(4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[(2,5-dimethylpyrazol-3-yl)methyl]-6-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Traditional Name: 4-[(2,5-dimethylpyrazol-3-yl)methyl]-6-[(Z)-(4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Formula: C18H16N4O3S2 MolecularWeight: 400.47464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CN2C(=O)COC3=C2C=C(C=C3)C=C4C(=O)NC(=S)S4)C

Isomeric SMILES

CC1=NN(C(=C1)CN2C(=O)COC3=C2C=C(C=C3)/C=C\4/C(=O)NC(=S)S4)C

InChI

InChI=1S/C18H16N4O3S2/c1-10-5-12(21(2)20-10)8-22-13-6-11(3-4-14(13)25-9-16(22)23)7-15-17(24)19-18(26)27-15/h3-7H,8-9H2,1-2H3,(H,19,24,26)/b15-7-