4-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoylamino]-N-(1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoylamino]-N-(1,3-thiazol-2-yl)benzamide Openeye Name: 4-[[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetyl]amino]-N-thiazol-2-yl-benzamide CAS Name: 4-[[2-[(4-methoxy-3-nitrophenyl)methylthio]-1-oxoethyl]amino]-N-(2-thiazolyl)benzamide IUPAC Name: 4-[[2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetyl]amino]-N-(1,3-thiazol-2-yl)benzamide Traditional Name: 4-[[2-[(4-methoxy-3-nitro-benzyl)thio]acetyl]amino]-N-thiazol-2-yl-benzamide Formula: C20H18N4O5S2 MolecularWeight: 458.51072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)NC3=NC=CS3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)NC3=NC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5S2/c1-29-17-7-2-13(10-16(17)24(27)28)11-30-12-18(25)22-15-5-3-14(4-6-15)19(26)23-20-21-8-9-31-20/h2-10H,11-12H2,1H3,(H,22,25)(H,21,23,26)