tert-butyl N-[4-[2-(1H-benzimidazol-2-ylamino)-2-oxidanylidene-ethyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[2-(1H-benzimidazol-2-ylamino)-2-oxidanylidene-ethyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[2-(1H-benzimidazol-2-ylamino)-2-oxo-ethyl]phenyl]carbamate CAS Name: N-[4-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[2-(1H-benzimidazol-2-ylamino)-2-oxoethyl]phenyl]carbamate Traditional Name: N-[4-[2-(1H-benzimidazol-2-ylamino)-2-keto-ethyl]phenyl]carbamic acid tert-butyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CC(=O)NC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CC(=O)NC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H22N4O3/c1-20(2,3)27-19(26)21-14-10-8-13(9-11-14)12-17(25)24-18-22-15-6-4-5-7-16(15)23-18/h4-11H,12H2,1-3H3,(H,21,26)(H2,22,23,24,25)