N-(3-chloranyl-2,6-diethyl-phenyl)-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-4-(methylthio)-3-nitro-benzamide Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN2O3S/c1-4-11-6-8-14(19)13(5-2)17(11)20-18(22)12-7-9-16(25-3)15(10-12)21(23)24/h6-10H,4-5H2,1-3H3,(H,20,22)