phenethyl N-[2-azanyl-6-[(phenylmethyl)amino]pyridin-3-yl]carbamate

Systemtic Name: phenethyl N-[2-azanyl-6-[(phenylmethyl)amino]pyridin-3-yl]carbamate Openeye Name: phenethyl N-[2-amino-6-(benzylamino)-3-pyridyl]carbamate CAS Name: N-[2-amino-6-[(phenylmethyl)amino]-3-pyridinyl]carbamic acid phenethyl ester IUPAC Name: phenethyl N-[2-amino-6-(benzylamino)pyridin-3-yl]carbamate Traditional Name: N-[2-amino-6-(benzylamino)-3-pyridyl]carbamic acid phenethyl ester Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(=O)NC2=C(N=C(C=C2)NCC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CCOC(=O)NC2=C(N=C(C=C2)NCC3=CC=CC=C3)N

InChI

InChI=1S/C21H22N4O2/c22-20-18(24-21(26)27-14-13-16-7-3-1-4-8-16)11-12-19(25-20)23-15-17-9-5-2-6-10-17/h1-12H,13-15H2,(H,24,26)(H3,22,23,25)