N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-N-methyl-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C18H15ClN4O3S MolecularWeight: 402.8547

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2=CNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2=CNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C18H15ClN4O3S/c1-21(11-12-9-14(23(25)26)7-8-15(12)19)17(24)16-10-20-18(27)22(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,20,27)