4-azanyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[(E)-cinnamyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[(E)-3-phenylprop-2-enyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[(E)-3-phenylprop-2-enyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[(E)-cinnamyl]thio]pyrimidine-5-carbonitrile Formula: C14H12N4S MolecularWeight: 268.33688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C14H12N4S/c15-9-12-10-17-14(18-13(12)16)19-8-4-7-11-5-2-1-3-6-11/h1-7,10H,8H2,(H2,16,17,18)/b7-4+