4-(phenylmethylsulfanyl)-2-thiophen-2-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(phenylmethylsulfanyl)-2-thiophen-2-yl-pyrimidine-5-carbonitrile Openeye Name: 4-benzylsulfanyl-2-(2-thienyl)pyrimidine-5-carbonitrile CAS Name: 4-(phenylmethylthio)-2-thiophen-2-yl-5-pyrimidinecarbonitrile IUPAC Name: 4-benzylsulfanyl-2-thiophen-2-ylpyrimidine-5-carbonitrile Traditional Name: 4-(benzylthio)-2-(2-thienyl)pyrimidine-5-carbonitrile Formula: C16H11N3S2 MolecularWeight: 309.40864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=NC=C2C#N)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=NC=C2C#N)C3=CC=CS3

InChI

InChI=1S/C16H11N3S2/c17-9-13-10-18-15(14-7-4-8-20-14)19-16(13)21-11-12-5-2-1-3-6-12/h1-8,10H,11H2