2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2CC(=O)NC3=CC=CC=C3S2)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2CC(=O)NC3=CC=CC=C3S2)OC)OC

InChI

InChI=1S/C18H19NO4S/c1-21-13-9-8-11(17(22-2)18(13)23-3)15-10-16(20)19-12-6-4-5-7-14(12)24-15/h4-9,15H,10H2,1-3H3,(H,19,20)