[2-(4-methyl-2-oxidanylidene-3-phenyl-chromen-7-yl)oxyethanoylamino]carbamodithioic acid

Systemtic Name: [2-(4-methyl-2-oxidanylidene-3-phenyl-chromen-7-yl)oxyethanoylamino]carbamodithioic acid Openeye Name: [[2-(4-methyl-2-oxo-3-phenyl-chromen-7-yl)oxyacetyl]amino]carbamodithioic acid CAS Name: [[2-[(4-methyl-2-oxo-3-phenyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]carbamodithioic acid IUPAC Name: [[2-(4-methyl-2-oxo-3-phenylchromen-7-yl)oxyacetyl]amino]carbamodithioic acid Traditional Name: [[2-(2-keto-4-methyl-3-phenyl-chromen-7-yl)oxyacetyl]amino]carbamodithioic acid Formula: C19H16N2O4S2 MolecularWeight: 400.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)NNC(=S)S)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)NNC(=S)S)C3=CC=CC=C3

InChI

InChI=1S/C19H16N2O4S2/c1-11-14-8-7-13(24-10-16(22)20-21-19(26)27)9-15(14)25-18(23)17(11)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,20,22)(H2,21,26,27)