(4-ethoxy-3-methoxy-phenyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Openeye Name: (4-ethoxy-3-methoxy-phenyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone CAS Name: (4-ethoxy-3-methoxyphenyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone IUPAC Name: (4-ethoxy-3-methoxyphenyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Traditional Name: (4-ethoxy-3-methoxy-phenyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCC(SC3=CC=CC=C32)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCC(SC3=CC=CC=C32)C)OC

InChI

InChI=1S/C20H23NO3S/c1-4-24-17-10-9-15(13-18(17)23-3)20(22)21-12-11-14(2)25-19-8-6-5-7-16(19)21/h5-10,13-14H,4,11-12H2,1-3H3