4-methoxy-2-[[2-(3-methoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]methyl]phenol

Systemtic Name: 4-methoxy-2-[[2-(3-methoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]methyl]phenol Openeye Name: 4-methoxy-2-[[2-(3-methoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]methyl]phenol CAS Name: 4-methoxy-2-[[2-(3-methoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]methyl]phenol IUPAC Name: 4-methoxy-2-[[2-(3-methoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]methyl]phenol Traditional Name: 4-methoxy-2-[[2-(3-methoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]methyl]phenol Formula: C24H25NO3S MolecularWeight: 407.5252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)CN2CCC(SC3=CC=CC=C32)C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)O)CN2CCC(SC3=CC=CC=C32)C4=CC(=CC=C4)OC

InChI

InChI=1S/C24H25NO3S/c1-27-19-7-5-6-17(14-19)23-12-13-25(21-8-3-4-9-24(21)29-23)16-18-15-20(28-2)10-11-22(18)26/h3-11,14-15,23,26H,12-13,16H2,1-2H3