3-(2-chloranyl-4,6-dimethyl-phenyl)-4-methoxycarbothioyloxy-6-pyridin-3-yl-pyran-2-one

Systemtic Name: 3-(2-chloranyl-4,6-dimethyl-phenyl)-4-methoxycarbothioyloxy-6-pyridin-3-yl-pyran-2-one Openeye Name: 3-(2-chloro-4,6-dimethyl-phenyl)-4-methoxycarbothioyloxy-6-(3-pyridyl)pyran-2-one CAS Name: 3-(2-chloro-4,6-dimethylphenyl)-4-[methoxy(sulfanylidene)methoxy]-6-(3-pyridinyl)-2-pyranone IUPAC Name: 3-(2-chloro-4,6-dimethylphenyl)-4-methoxycarbothioyloxy-6-pyridin-3-ylpyran-2-one Traditional Name: 3-(2-chloro-4,6-dimethyl-phenyl)-4-methoxycarbothioyloxy-6-(3-pyridyl)pyran-2-one Formula: C20H16ClNO4S MolecularWeight: 401.86334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)C2=C(C=C(OC2=O)C3=CN=CC=C3)OC(=S)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)C2=C(C=C(OC2=O)C3=CN=CC=C3)OC(=S)OC)C

InChI

InChI=1S/C20H16ClNO4S/c1-11-7-12(2)17(14(21)8-11)18-16(26-20(27)24-3)9-15(25-19(18)23)13-5-4-6-22-10-13/h4-10H,1-3H3