N-[1-[2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[1-[2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[1-[[[4-(2,5-dimethylpyrrol-1-yl)benzoyl]amino]carbamoyl]-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[1-[[[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-oxomethyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[1-[2-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[1-[[[4-(2,5-dimethylpyrrol-1-yl)benzoyl]amino]carbamoyl]-3-(methylthio)propyl]-2-phenoxy-acetamide Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NNC(=O)C(CCSC)NC(=O)COC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NNC(=O)C(CCSC)NC(=O)COC3=CC=CC=C3)C

InChI

InChI=1S/C26H30N4O4S/c1-18-9-10-19(2)30(18)21-13-11-20(12-14-21)25(32)28-29-26(33)23(15-16-35-3)27-24(31)17-34-22-7-5-4-6-8-22/h4-14,23H,15-17H2,1-3H3,(H,27,31)(H,28,32)(H,29,33)