2-butan-2-yl-3-ethyl-7-methoxy-5-phenyl-2,3,4,5-tetrahydro-1$l^{4},4-benzothiazepine 1-oxide

Systemtic Name: 2-butan-2-yl-3-ethyl-7-methoxy-5-phenyl-2,3,4,5-tetrahydro-1$l^{4},4-benzothiazepine 1-oxide Openeye Name: 3-ethyl-7-methoxy-5-phenyl-2-sec-butyl-2,3,4,5-tetrahydro-1$l^{4},4-benzothiazepine 1-oxide CAS Name: 2-butan-2-yl-3-ethyl-7-methoxy-5-phenyl-2,3,4,5-tetrahydro-1$l^{4},4-benzothiazepine 1-oxide IUPAC Name: 2-butan-2-yl-3-ethyl-7-methoxy-5-phenyl-2,3,4,5-tetrahydro-1$l^{4},4-benzothiazepine 1-oxide Traditional Name: 3-ethyl-7-methoxy-5-phenyl-2-sec-butyl-2,3,4,5-tetrahydro-1$l^{4},4-benzothiazepine 1-oxide Formula: C22H29NO2S MolecularWeight: 371.53616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(S(=O)C2=C(C=C(C=C2)OC)C(N1)C3=CC=CC=C3)C(C)CC

Isomeric SMILES

CCC1C(S(=O)C2=C(C=C(C=C2)OC)C(N1)C3=CC=CC=C3)C(C)CC

InChI

InChI=1S/C22H29NO2S/c1-5-15(3)22-19(6-2)23-21(16-10-8-7-9-11-16)18-14-17(25-4)12-13-20(18)26(22)24/h7-15,19,21-23H,5-6H2,1-4H3