[(4S)-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone

Systemtic Name: [(4S)-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone Openeye Name: [(4S)-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone CAS Name: [(4S)-4-(3-methoxy-4-propoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenylmethanone IUPAC Name: [(4S)-4-(3-methoxy-4-propoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenylmethanone Traditional Name: [(4S)-4-(3-methoxy-4-propoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H]2C(=C(NC(=S)N2)C)C(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H24N2O3S/c1-4-12-27-17-11-10-16(13-18(17)26-3)20-19(14(2)23-22(28)24-20)21(25)15-8-6-5-7-9-15/h5-11,13,20H,4,12H2,1-3H3,(H2,23,24,28)/t20-/m0/s1