(4S)-3-ethanoyl-2-methyl-4-(3-nitrophenyl)-6-prop-2-enylsulfanyl-3,4-dihydropyridine-5-carbonitrile

Systemtic Name: (4S)-3-ethanoyl-2-methyl-4-(3-nitrophenyl)-6-prop-2-enylsulfanyl-3,4-dihydropyridine-5-carbonitrile Openeye Name: (4S)-3-acetyl-6-allylsulfanyl-2-methyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carbonitrile CAS Name: (4S)-3-acetyl-2-methyl-4-(3-nitrophenyl)-6-(prop-2-enylthio)-3,4-dihydropyridine-5-carbonitrile IUPAC Name: (4S)-3-acetyl-2-methyl-4-(3-nitrophenyl)-6-prop-2-enylsulfanyl-3,4-dihydropyridine-5-carbonitrile Traditional Name: (4S)-3-acetyl-6-(allylthio)-2-methyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carbonitrile Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)C)C2=CC(=CC=C2)[N+](=O)[O-])C#N)SCC=C

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)C)C2=CC(=CC=C2)[N+](=O)[O-])C#N)SCC=C

InChI

InChI=1S/C18H17N3O3S/c1-4-8-25-18-15(10-19)17(16(12(3)22)11(2)20-18)13-6-5-7-14(9-13)21(23)24/h4-7,9,16-17H,1,8H2,2-3H3/t16?,17-/m0/s1