N-[1-[(3-aminocarbonylphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-[1-[(3-aminocarbonylphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-chloranyl-3-nitro-benzamide Openeye Name: N-[1-[(3-carbamoylphenyl)carbamoyl]-3-methylsulfanyl-propyl]-4-chloro-3-nitro-benzamide CAS Name: N-[1-(3-carbamoylanilino)-4-(methylthio)-1-oxobutan-2-yl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[1-(3-carbamoylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-4-chloro-3-nitrobenzamide Traditional Name: N-[1-[(3-carbamoylphenyl)carbamoyl]-3-(methylthio)propyl]-4-chloro-3-nitro-benzamide Formula: C19H19ClN4O5S MolecularWeight: 450.89596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=CC(=C1)C(=O)N)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C(=O)NC1=CC=CC(=C1)C(=O)N)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O5S/c1-30-8-7-15(19(27)22-13-4-2-3-11(9-13)17(21)25)23-18(26)12-5-6-14(20)16(10-12)24(28)29/h2-6,9-10,15H,7-8H2,1H3,(H2,21,25)(H,22,27)(H,23,26)