1,3-bis(3-chlorophenyl)-5,7,7-trimethyl-2-sulfanylidene-pyrano[2,3-d]pyrimidin-4-one

Systemtic Name: 1,3-bis(3-chlorophenyl)-5,7,7-trimethyl-2-sulfanylidene-pyrano[2,3-d]pyrimidin-4-one Openeye Name: 1,3-bis(3-chlorophenyl)-5,7,7-trimethyl-2-thioxo-pyrano[2,3-d]pyrimidin-4-one CAS Name: 1,3-bis(3-chlorophenyl)-5,7,7-trimethyl-2-sulfanylidene-4-pyrano[2,3-d]pyrimidinone IUPAC Name: 1,3-bis(3-chlorophenyl)-5,7,7-trimethyl-2-sulfanylidenepyrano[2,3-d]pyrimidin-4-one Traditional Name: 1,3-bis(3-chlorophenyl)-5,7,7-trimethyl-2-thioxo-pyrano[2,3-d]pyrimidin-4-one Formula: C22H18Cl2N2O2S MolecularWeight: 445.36152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(OC2=C1C(=O)N(C(=S)N2C3=CC(=CC=C3)Cl)C4=CC(=CC=C4)Cl)(C)C

Isomeric SMILES

CC1=CC(OC2=C1C(=O)N(C(=S)N2C3=CC(=CC=C3)Cl)C4=CC(=CC=C4)Cl)(C)C

InChI

InChI=1S/C22H18Cl2N2O2S/c1-13-12-22(2,3)28-20-18(13)19(27)25(16-8-4-6-14(23)10-16)21(29)26(20)17-9-5-7-15(24)11-17/h4-12H,1-3H3