N-[(3,4-dichlorophenyl)methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine Openeye Name: N-[(3,4-dichlorophenyl)methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine CAS Name: N-[(3,4-dichlorophenyl)methyl]-3-(2-pyrimidinylthio)-1-propanamine IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-3-pyrimidin-2-ylsulfanylpropan-1-amine Traditional Name: (3,4-dichlorobenzyl)-[3-(2-pyrimidylthio)propyl]amine Formula: C14H15Cl2N3S MolecularWeight: 328.26

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCCNCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CN=C(N=C1)SCCCNCC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H15Cl2N3S/c15-12-4-3-11(9-13(12)16)10-17-5-2-8-20-14-18-6-1-7-19-14/h1,3-4,6-7,9,17H,2,5,8,10H2