3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[(3-pyrimidin-2-yloxyphenyl)methyl]propan-1-amine

Systemtic Name: 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[(3-pyrimidin-2-yloxyphenyl)methyl]propan-1-amine Openeye Name: 3-(1-methyltetrazol-5-yl)sulfanyl-N-[(3-pyrimidin-2-yloxyphenyl)methyl]propan-1-amine CAS Name: 3-[(1-methyl-5-tetrazolyl)thio]-N-[[3-(2-pyrimidinyloxy)phenyl]methyl]-1-propanamine IUPAC Name: 3-(1-methyltetrazol-5-yl)sulfanyl-N-[(3-pyrimidin-2-yloxyphenyl)methyl]propan-1-amine Traditional Name: 3-[(1-methyltetrazol-5-yl)thio]propyl-[3-(2-pyrimidyloxy)benzyl]amine Formula: C16H19N7OS MolecularWeight: 357.43336

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCNCC2=CC(=CC=C2)OC3=NC=CC=N3

Isomeric SMILES

CN1C(=NN=N1)SCCCNCC2=CC(=CC=C2)OC3=NC=CC=N3

InChI

InChI=1S/C16H19N7OS/c1-23-16(20-21-22-23)25-10-4-7-17-12-13-5-2-6-14(11-13)24-15-18-8-3-9-19-15/h2-3,5-6,8-9,11,17H,4,7,10,12H2,1H3