ethyl 1-ethanoyl-10-methyl-4,4-diphenyl-furo[2,3-c][1,5]benzothiazepine-2-carboxylate

Systemtic Name: ethyl 1-ethanoyl-10-methyl-4,4-diphenyl-furo[2,3-c][1,5]benzothiazepine-2-carboxylate Openeye Name: ethyl 1-acetyl-10-methyl-4,4-diphenyl-furo[2,3-c][1,5]benzothiazepine-2-carboxylate CAS Name: 1-acetyl-10-methyl-4,4-diphenyl-2-furo[2,3-c][1,5]benzothiazepinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-acetyl-10-methyl-4,4-diphenylfuro[2,3-c][1,5]benzothiazepine-2-carboxylate Traditional Name: 1-acetyl-10-methyl-4,4-diphenyl-furo[2,3-c][1,5]benzothiazepine-2-carboxylic acid ethyl ester Formula: C29H25NO4S MolecularWeight: 483.5781

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C(SC3=CC=CC=C3N2C)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C(SC3=CC=CC=C3N2C)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C

InChI

InChI=1S/C29H25NO4S/c1-4-33-28(32)26-24(19(2)31)25-27(34-26)29(20-13-7-5-8-14-20,21-15-9-6-10-16-21)35-23-18-12-11-17-22(23)30(25)3/h5-18H,4H2,1-3H3