1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone Openeye Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(2-isopropyl-5-methyl-phenoxy)ethanone CAS Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)ethanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(5-methyl-2-propan-2-ylphenoxy)ethanone Traditional Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(2-isopropyl-5-methyl-phenoxy)ethanone Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C21H25NO2S/c1-15(2)17-10-9-16(3)13-19(17)24-14-21(23)22-11-6-12-25-20-8-5-4-7-18(20)22/h4-5,7-10,13,15H,6,11-12,14H2,1-3H3