3-butyl-3-ethyl-5-phenyl-2,4-dihydro-1,5-benzothiazepine

Systemtic Name: 3-butyl-3-ethyl-5-phenyl-2,4-dihydro-1,5-benzothiazepine Openeye Name: 3-butyl-3-ethyl-5-phenyl-2,4-dihydro-1,5-benzothiazepine CAS Name: 3-butyl-3-ethyl-5-phenyl-2,4-dihydro-1,5-benzothiazepine IUPAC Name: 3-butyl-3-ethyl-5-phenyl-2,4-dihydro-1,5-benzothiazepine Traditional Name: 3-butyl-3-ethyl-5-phenyl-2,4-dihydro-1,5-benzothiazepine Formula: C21H27NS MolecularWeight: 325.51078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CN(C2=CC=CC=C2SC1)C3=CC=CC=C3)CC

Isomeric SMILES

CCCCC1(CN(C2=CC=CC=C2SC1)C3=CC=CC=C3)CC

InChI

InChI=1S/C21H27NS/c1-3-5-15-21(4-2)16-22(18-11-7-6-8-12-18)19-13-9-10-14-20(19)23-17-21/h6-14H,3-5,15-17H2,1-2H3