N-[(E)-butylideneamino]-2-(phenylmethylsulfanyl)pyrimidin-4-amine

Systemtic Name: N-[(E)-butylideneamino]-2-(phenylmethylsulfanyl)pyrimidin-4-amine Openeye Name: 2-benzylsulfanyl-N-[(E)-butylideneamino]pyrimidin-4-amine CAS Name: N-[(E)-butylideneamino]-2-(phenylmethylthio)-4-pyrimidinamine IUPAC Name: 2-benzylsulfanyl-N-[(E)-butylideneamino]pyrimidin-4-amine Traditional Name: [2-(benzylthio)pyrimidin-4-yl]-[(E)-butylideneamino]amine Formula: C15H18N4S MolecularWeight: 286.39522

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=NNC1=NC(=NC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CCC/C=N/NC1=NC(=NC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C15H18N4S/c1-2-3-10-17-19-14-9-11-16-15(18-14)20-12-13-7-5-4-6-8-13/h4-11H,2-3,12H2,1H3,(H,16,18,19)/b17-10+