methyl 3-[1-(3,4-dichlorophenyl)propyl]-5-pyrazin-2-yl-2-sulfanylidene-1H-imidazole-4-carboxylate

Systemtic Name: methyl 3-[1-(3,4-dichlorophenyl)propyl]-5-pyrazin-2-yl-2-sulfanylidene-1H-imidazole-4-carboxylate Openeye Name: methyl 3-[1-(3,4-dichlorophenyl)propyl]-5-pyrazin-2-yl-2-thioxo-1H-imidazole-4-carboxylate CAS Name: 3-[1-(3,4-dichlorophenyl)propyl]-5-(2-pyrazinyl)-2-sulfanylidene-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-[1-(3,4-dichlorophenyl)propyl]-5-pyrazin-2-yl-2-sulfanylidene-1H-imidazole-4-carboxylate Traditional Name: 3-[1-(3,4-dichlorophenyl)propyl]-5-pyrazin-2-yl-2-thioxo-4-imidazoline-4-carboxylic acid methyl ester Formula: C18H16Cl2N4O2S MolecularWeight: 423.31624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)Cl)Cl)N2C(=C(NC2=S)C3=NC=CN=C3)C(=O)OC

Isomeric SMILES

CCC(C1=CC(=C(C=C1)Cl)Cl)N2C(=C(NC2=S)C3=NC=CN=C3)C(=O)OC

InChI

InChI=1S/C18H16Cl2N4O2S/c1-3-14(10-4-5-11(19)12(20)8-10)24-16(17(25)26-2)15(23-18(24)27)13-9-21-6-7-22-13/h4-9,14H,3H2,1-2H3,(H,23,27)