N-[(E)-1-(4-butylphenyl)ethylideneamino]-2-(phenylmethylsulfanyl)pyrimidin-4-amine

Systemtic Name: N-[(E)-1-(4-butylphenyl)ethylideneamino]-2-(phenylmethylsulfanyl)pyrimidin-4-amine Openeye Name: 2-benzylsulfanyl-N-[(E)-1-(4-butylphenyl)ethylideneamino]pyrimidin-4-amine CAS Name: N-[(E)-1-(4-butylphenyl)ethylideneamino]-2-(phenylmethylthio)-4-pyrimidinamine IUPAC Name: 2-benzylsulfanyl-N-[(E)-1-(4-butylphenyl)ethylideneamino]pyrimidin-4-amine Traditional Name: [2-(benzylthio)pyrimidin-4-yl]-[(E)-1-(4-butylphenyl)ethylideneamino]amine Formula: C23H26N4S MolecularWeight: 390.54434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=NNC2=NC(=NC=C2)SCC3=CC=CC=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)/C(=N/NC2=NC(=NC=C2)SCC3=CC=CC=C3)/C

InChI

InChI=1S/C23H26N4S/c1-3-4-8-19-11-13-21(14-12-19)18(2)26-27-22-15-16-24-23(25-22)28-17-20-9-6-5-7-10-20/h5-7,9-16H,3-4,8,17H2,1-2H3,(H,24,25,27)/b26-18+