7-phenyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-7-carbonitrile

Systemtic Name: 7-phenyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-7-carbonitrile Openeye Name: 7-phenyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-benzothiopheno[2,3-d]pyrimidine-7-carbonitrile CAS Name: 7-phenyl-4-(1-pyrrolidinyl)-6,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-7-carbonitrile IUPAC Name: 7-phenyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-7-carbonitrile Traditional Name: 7-phenyl-4-pyrrolidino-6,8-dihydro-5H-benzothiopheno[2,3-d]pyrimidine-7-carbonitrile Formula: C21H20N4S MolecularWeight: 360.4753

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C3C4=C(CC(CC4)(C#N)C5=CC=CC=C5)SC3=NC=N2

Isomeric SMILES

C1CCN(C1)C2=C3C4=C(CC(CC4)(C#N)C5=CC=CC=C5)SC3=NC=N2

InChI

InChI=1S/C21H20N4S/c22-13-21(15-6-2-1-3-7-15)9-8-16-17(12-21)26-20-18(16)19(23-14-24-20)25-10-4-5-11-25/h1-3,6-7,14H,4-5,8-12H2