N-[(4-ethoxy-3-methoxy-phenyl)methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-3-(2-pyrimidinylthio)-1-propanamine IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-3-pyrimidin-2-ylsulfanylpropan-1-amine Traditional Name: (4-ethoxy-3-methoxy-benzyl)-[3-(2-pyrimidylthio)propyl]amine Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNCCCSC2=NC=CC=N2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNCCCSC2=NC=CC=N2)OC

InChI

InChI=1S/C17H23N3O2S/c1-3-22-15-7-6-14(12-16(15)21-2)13-18-8-5-11-23-17-19-9-4-10-20-17/h4,6-7,9-10,12,18H,3,5,8,11,13H2,1-2H3