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4-chloranyl-3-nitro-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide

Systemtic Name:	4-chloranyl-3-nitro-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide
Openeye Name:	4-chloro-3-nitro-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide
CAS Name:	4-chloro-3-nitro-N-[sulfanylidene-(2,4,6-trimethylanilino)methyl]benzamide
IUPAC Name:	4-chloro-3-nitro-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide
Traditional Name:	4-chloro-N-(mesitylthiocarbamoyl)-3-nitro-benzamide
Formula:	C₁₇H₁₆ClN₃O₃S
MolecularWeight:	377.84524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C17H16ClN3O3S/c1-9-6-10(2)15(11(3)7-9)19-17(25)20-16(22)12-4-5-13(18)14(8-12)21(23)24/h4-8H,1-3H3,(H2,19,20,22,25)

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