3-bromanyl-7-phenylsulfanyl-5-pyridin-2-yl-3,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

Systemtic Name: 3-bromanyl-7-phenylsulfanyl-5-pyridin-2-yl-3,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine Openeye Name: 3-bromo-7-phenylsulfanyl-5-(2-pyridyl)-3,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine CAS Name: 3-bromo-7-(phenylthio)-5-(2-pyridinyl)-3,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine IUPAC Name: 3-bromo-7-phenylsulfanyl-5-pyridin-2-yl-3,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine Traditional Name: 3-bromo-7-(phenylthio)-5-(2-pyridyl)-3,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine Formula: C17H15BrN4S MolecularWeight: 387.2968

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C2C(C=NN2C1SC3=CC=CC=C3)Br)C4=CC=CC=N4

Isomeric SMILES

C1C(N=C2C(C=NN2C1SC3=CC=CC=C3)Br)C4=CC=CC=N4

InChI

InChI=1S/C17H15BrN4S/c18-13-11-20-22-16(23-12-6-2-1-3-7-12)10-15(21-17(13)22)14-8-4-5-9-19-14/h1-9,11,13,15-16H,10H2