N-[1-[2-(3,4-dichlorophenyl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[1-[2-(3,4-dichlorophenyl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: N-[1-[(3,4-dichloroanilino)carbamoyl]-3-methylsulfanyl-propyl]-3-nitro-benzamide CAS Name: N-[1-[(3,4-dichlorophenyl)hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: N-[1-[2-(3,4-dichlorophenyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: N-[1-[(3,4-dichloroanilino)carbamoyl]-3-(methylthio)propyl]-3-nitro-benzamide Formula: C18H18Cl2N4O4S MolecularWeight: 457.33092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C(=O)NNC1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18Cl2N4O4S/c1-29-8-7-16(18(26)23-22-12-5-6-14(19)15(20)10-12)21-17(25)11-3-2-4-13(9-11)24(27)28/h2-6,9-10,16,22H,7-8H2,1H3,(H,21,25)(H,23,26)