4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-sulfanyl-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-sulfanyl-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-2-sulfanyl-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-mercapto-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-2-sulfanyl-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 5-keto-2-mercapto-4-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)S)C#N)C3=CC=C(C=C3)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)S)C#N)C3=CC=C(C=C3)OC)C(=O)C1)C

InChI

InChI=1S/C19H19NO3S/c1-19(2)8-14(21)17-15(9-19)23-18(24)13(10-20)16(17)11-4-6-12(22-3)7-5-11/h4-7,16,24H,8-9H2,1-3H3