[azanyl-[(5-ethanoyl-3-ethoxycarbonyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyridin-2-yl)methylsulfanyl]methylidene]azanium chloride

Systemtic Name: [azanyl-[(5-ethanoyl-3-ethoxycarbonyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyridin-2-yl)methylsulfanyl]methylidene]azanium chloride Openeye Name: [[5-acetyl-3-ethoxycarbonyl-6-methyl-4-(2-thienyl)-1,4-dihydropyridin-2-yl]methylsulfanyl-amino-methylene]ammonium chloride CAS Name: [[(5-acetyl-3-ethoxycarbonyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyridin-2-yl)methylthio]-aminomethylidene]ammonium chloride IUPAC Name: [(5-acetyl-3-ethoxycarbonyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyridin-2-yl)methylsulfanyl-aminomethylidene]azanium chloride Traditional Name: [[[5-acetyl-3-carbethoxy-6-methyl-4-(2-thienyl)-1,4-dihydropyridin-2-yl]methylthio]-amino-methylene]ammonium chloride Formula: C17H22ClN3O3S2 MolecularWeight: 415.95788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CS2)C(=O)C)C)CSC(=[NH2+])N.[Cl-]

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CS2)C(=O)C)C)CSC(=[NH2+])N.[Cl-]

InChI

InChI=1S/C17H21N3O3S2.ClH/c1-4-23-16(22)14-11(8-25-17(18)19)20-9(2)13(10(3)21)15(14)12-6-5-7-24-12;/h5-7,15,20H,4,8H2,1-3H3,(H3,18,19);1H