5-phenyl-4-(pyridin-3-ylmethylsulfanyl)thieno[2,3-d]pyrimidine

Systemtic Name: 5-phenyl-4-(pyridin-3-ylmethylsulfanyl)thieno[2,3-d]pyrimidine Openeye Name: 5-phenyl-4-(3-pyridylmethylsulfanyl)thieno[2,3-d]pyrimidine CAS Name: 5-phenyl-4-(3-pyridinylmethylthio)thieno[2,3-d]pyrimidine IUPAC Name: 5-phenyl-4-(pyridin-3-ylmethylsulfanyl)thieno[2,3-d]pyrimidine Traditional Name: 5-phenyl-4-(3-pyridylmethylthio)thieno[2,3-d]pyrimidine Formula: C18H13N3S2 MolecularWeight: 335.44592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC4=CN=CC=C4

InChI

InChI=1S/C18H13N3S2/c1-2-6-14(7-3-1)15-11-23-18-16(15)17(20-12-21-18)22-10-13-5-4-8-19-9-13/h1-9,11-12H,10H2