(2-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]azanium

Systemtic Name: (2-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]azanium Openeye Name: (2-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidin-6-yl]methyl]ammonium CAS Name: (2-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]ammonium IUPAC Name: (2-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]azanium Traditional Name: [(4R)-5-carbethoxy-2-keto-4-(2-thienyl)-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(2-chlorobenzyl)ammonium Formula: C19H21ClN3O3S+ MolecularWeight: 406.90634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)C[NH2+]CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=CS2)C[NH2+]CC3=CC=CC=C3Cl

InChI

InChI=1S/C19H20ClN3O3S/c1-2-26-18(24)16-14(11-21-10-12-6-3-4-7-13(12)20)22-19(25)23-17(16)15-8-5-9-27-15/h3-9,17,21H,2,10-11H2,1H3,(H2,22,23,25)/p+1/t17-/m0/s1