2-tert-butyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine

Systemtic Name: 2-tert-butyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine Openeye Name: 2-tert-butyl-4-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-b]pyridine CAS Name: 2-tert-butyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine IUPAC Name: 2-tert-butyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine Traditional Name: 2-tert-butyl-4-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-b]pyridine Formula: C21H23NS MolecularWeight: 321.47902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C3=C(S2)CCCC3)C(=C1)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NC2=C(C3=C(S2)CCCC3)C(=C1)C4=CC=CC=C4

InChI

InChI=1S/C21H23NS/c1-21(2,3)18-13-16(14-9-5-4-6-10-14)19-15-11-7-8-12-17(15)23-20(19)22-18/h4-6,9-10,13H,7-8,11-12H2,1-3H3