3-butan-2-yl-3-methyl-5-phenyl-4,5-dihydro-2H-1,4-benzothiazepine

Systemtic Name: 3-butan-2-yl-3-methyl-5-phenyl-4,5-dihydro-2H-1,4-benzothiazepine Openeye Name: 3-methyl-5-phenyl-3-sec-butyl-4,5-dihydro-2H-1,4-benzothiazepine CAS Name: 3-butan-2-yl-3-methyl-5-phenyl-4,5-dihydro-2H-1,4-benzothiazepine IUPAC Name: 3-butan-2-yl-3-methyl-5-phenyl-4,5-dihydro-2H-1,4-benzothiazepine Traditional Name: 3-methyl-5-phenyl-3-sec-butyl-4,5-dihydro-2H-1,4-benzothiazepine Formula: C20H25NS MolecularWeight: 311.4842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(CSC2=CC=CC=C2C(N1)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C)C1(CSC2=CC=CC=C2C(N1)C3=CC=CC=C3)C

InChI

InChI=1S/C20H25NS/c1-4-15(2)20(3)14-22-18-13-9-8-12-17(18)19(21-20)16-10-6-5-7-11-16/h5-13,15,19,21H,4,14H2,1-3H3