2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H23N3O2S2 MolecularWeight: 401.54552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3CCCSC4=CC=CC=C43)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3CCCSC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C20H23N3O2S2/c21-19(25)18-13-6-1-3-8-15(13)27-20(18)22-17(24)12-23-10-5-11-26-16-9-4-2-7-14(16)23/h2,4,7,9H,1,3,5-6,8,10-12H2,(H2,21,25)(H,22,24)