benzene; N-(2,4-dinitrophenyl)sulfanyl-N-methyl-N'-(4-methylphenyl)benzenecarboximidamide

Systemtic Name: benzene; N-(2,4-dinitrophenyl)sulfanyl-N-methyl-N'-(4-methylphenyl)benzenecarboximidamide Openeye Name: benzene; N-(2,4-dinitrophenyl)sulfanyl-N-methyl-N'-(p-tolyl)benzamidine CAS Name: benzene; N-[(2,4-dinitrophenyl)thio]-N-methyl-N'-(4-methylphenyl)benzenecarboximidamide IUPAC Name: benzene; N-(2,4-dinitrophenyl)sulfanyl-N-methyl-N'-(4-methylphenyl)benzenecarboximidamide Traditional Name: benzene; N-[(2,4-dinitrophenyl)thio]-N-methyl-N'-(p-tolyl)benzamidine Formula: C27H24N4O4S MolecularWeight: 500.56886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(C2=CC=CC=C2)N(C)SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-].C1=CC=CC=C1

Isomeric SMILES

CC1=CC=C(C=C1)N=C(C2=CC=CC=C2)N(C)SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-].C1=CC=CC=C1

InChI

InChI=1S/C21H18N4O4S.C6H6/c1-15-8-10-17(11-9-15)22-21(16-6-4-3-5-7-16)23(2)30-20-13-12-18(24(26)27)14-19(20)25(28)29;1-2-4-6-5-3-1/h3-14H,1-2H3;1-6H