tert-butyl N-[4-[3-(benzimidazol-1-yl)propylcarbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[3-(benzimidazol-1-yl)propylcarbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[3-(benzimidazol-1-yl)propylcarbamoyl]phenyl]carbamate CAS Name: N-[4-[[3-(1-benzimidazolyl)propylamino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[3-(benzimidazol-1-yl)propylcarbamoyl]phenyl]carbamate Traditional Name: N-[4-[3-(benzimidazol-1-yl)propylcarbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NCCCN2C=NC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NCCCN2C=NC3=CC=CC=C32

InChI

InChI=1S/C22H26N4O3/c1-22(2,3)29-21(28)25-17-11-9-16(10-12-17)20(27)23-13-6-14-26-15-24-18-7-4-5-8-19(18)26/h4-5,7-12,15H,6,13-14H2,1-3H3,(H,23,27)(H,25,28)