N-[1-[2-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]ethanamide

Systemtic Name: N-[1-[2-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]ethanamide Openeye Name: N-[1-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]amino]carbamoyl]-2-methyl-propyl]acetamide CAS Name: N-[1-[[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]acetamide IUPAC Name: N-[1-[2-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]acetamide Traditional Name: N-[1-[[[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]amino]carbamoyl]-2-methyl-propyl]acetamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NNC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2)NC(=O)C

InChI

InChI=1S/C22H25N5O3S/c1-13(2)19(23-14(3)28)21(30)27-26-20(29)16-10-8-15(9-11-16)12-31-22-24-17-6-4-5-7-18(17)25-22/h4-11,13,19H,12H2,1-3H3,(H,23,28)(H,24,25)(H,26,29)(H,27,30)