N-(1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H18N2O3S/c21-18(19-13-6-7-15-16(10-13)23-12-22-15)11-20-8-3-9-24-17-5-2-1-4-14(17)20/h1-2,4-7,10H,3,8-9,11-12H2,(H,19,21)