3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3,4,5-triethoxyphenyl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3,4,5-triethoxyphenyl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3,4,5-triethoxyphenyl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3,4,5-triethoxyphenyl)methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3,4,5-triethoxyphenyl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3,4,5-triethoxyphenyl)methanone Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C22H27NO4S/c1-4-25-18-14-16(15-19(26-5-2)21(18)27-6-3)22(24)23-12-9-13-28-20-11-8-7-10-17(20)23/h7-8,10-11,14-15H,4-6,9,12-13H2,1-3H3