2-[(2-azanyl-1-oxidanyl-pentyl)amino]-N-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]ethanamide

Systemtic Name: 2-[(2-azanyl-1-oxidanyl-pentyl)amino]-N-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]ethanamide Openeye Name: 2-[(2-amino-1-hydroxy-pentyl)amino]-N-[(1-tert-butyltetrazol-5-yl)-phenyl-methyl]acetamide CAS Name: 2-[(2-amino-1-hydroxypentyl)amino]-N-[(1-tert-butyl-5-tetrazolyl)-phenylmethyl]acetamide IUPAC Name: 2-[(2-amino-1-hydroxypentyl)amino]-N-[(1-tert-butyltetrazol-5-yl)-phenylmethyl]acetamide Traditional Name: 2-[(2-amino-1-hydroxy-pentyl)amino]-N-[(1-tert-butyltetrazol-5-yl)-phenyl-methyl]acetamide Formula: C19H31N7O2 MolecularWeight: 389.49514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(NCC(=O)NC(C1=CC=CC=C1)C2=NN=NN2C(C)(C)C)O)N

Isomeric SMILES

CCCC(C(NCC(=O)NC(C1=CC=CC=C1)C2=NN=NN2C(C)(C)C)O)N

InChI

InChI=1S/C19H31N7O2/c1-5-9-14(20)18(28)21-12-15(27)22-16(13-10-7-6-8-11-13)17-23-24-25-26(17)19(2,3)4/h6-8,10-11,14,16,18,21,28H,5,9,12,20H2,1-4H3,(H,22,27)