1-[1-[2-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylhydrazinyl]-4-methyl-1-oxidanylidene-pentan-2-yl]urea

Systemtic Name: 1-[1-[2-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylhydrazinyl]-4-methyl-1-oxidanylidene-pentan-2-yl]urea Openeye Name: [1-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]amino]carbamoyl]-3-methyl-butyl]urea CAS Name: [1-[[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]hydrazo]-4-methyl-1-oxopentan-2-yl]urea IUPAC Name: [1-[2-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]hydrazinyl]-4-methyl-1-oxopentan-2-yl]urea Traditional Name: [1-[[[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]amino]carbamoyl]-3-methyl-butyl]urea Formula: C22H26N6O3S MolecularWeight: 454.54524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N6O3S/c1-13(2)11-18(24-21(23)31)20(30)28-27-19(29)15-9-7-14(8-10-15)12-32-22-25-16-5-3-4-6-17(16)26-22/h3-10,13,18H,11-12H2,1-2H3,(H,25,26)(H,27,29)(H,28,30)(H3,23,24,31)