1-[4-azido-5-(4-methoxyphenyl)sulfanyl-1-methyl-pyrrol-2-yl]ethanone

Systemtic Name: 1-[4-azido-5-(4-methoxyphenyl)sulfanyl-1-methyl-pyrrol-2-yl]ethanone Openeye Name: 1-[4-azido-5-(4-methoxyphenyl)sulfanyl-1-methyl-pyrrol-2-yl]ethanone CAS Name: 1-[4-azido-5-[(4-methoxyphenyl)thio]-1-methyl-2-pyrrolyl]ethanone IUPAC Name: 1-[4-azido-5-(4-methoxyphenyl)sulfanyl-1-methylpyrrol-2-yl]ethanone Traditional Name: 1-[4-azido-5-[(4-methoxyphenyl)thio]-1-methyl-pyrrol-2-yl]ethanone Formula: C14H14N4O2S MolecularWeight: 302.35156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(N1C)SC2=CC=C(C=C2)OC)N=[N+]=[N-]

Isomeric SMILES

CC(=O)C1=CC(=C(N1C)SC2=CC=C(C=C2)OC)N=[N+]=[N-]

InChI

InChI=1S/C14H14N4O2S/c1-9(19)13-8-12(16-17-15)14(18(13)2)21-11-6-4-10(20-3)5-7-11/h4-8H,1-3H3