N-[bis(azanyl)methylidene]-2-ethyl-4-(2-methylphenyl)sulfanyl-5-nitro-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-4-(2-methylphenyl)sulfanyl-5-nitro-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-5-nitro-4-(o-tolylsulfanyl)benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-4-[(2-methylphenyl)thio]-5-nitrobenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-4-(2-methylphenyl)sulfanyl-5-nitrobenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-5-nitro-4-(o-tolylthio)benzamide Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])SC2=CC=CC=C2C

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])SC2=CC=CC=C2C

InChI

InChI=1S/C17H18N4O3S/c1-3-11-8-15(25-14-7-5-4-6-10(14)2)13(21(23)24)9-12(11)16(22)20-17(18)19/h4-9H,3H2,1-2H3,(H4,18,19,20,22)