tert-butyl N-[[4-[(1H-pyrrol-2-ylcarbonylamino)carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[(1H-pyrrol-2-ylcarbonylamino)carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[(1H-pyrrole-2-carbonylamino)carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[oxo-[[oxo(1H-pyrrol-2-yl)methyl]hydrazo]methyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[(1H-pyrrole-2-carbonylamino)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(1H-pyrrole-2-carbonylamino)carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CN2

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CN2

InChI

InChI=1S/C18H22N4O4/c1-18(2,3)26-17(25)20-11-12-6-8-13(9-7-12)15(23)21-22-16(24)14-5-4-10-19-14/h4-10,19H,11H2,1-3H3,(H,20,25)(H,21,23)(H,22,24)