2-[[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoyl]amino]thiophene-3-carboxamide

Systemtic Name: 2-[[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoyl]amino]thiophene-3-carboxamide Openeye Name: 2-[[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoyl]amino]thiophene-3-carboxamide CAS Name: 2-[[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)propanoyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)propanoyl]amino]thiophene-3-carboxamide Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)SC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CS1)C(=O)N)SC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H18N2O4S2/c1-10(16(21)19-17-12(15(18)20)5-8-24-17)25-11-3-4-13-14(9-11)23-7-2-6-22-13/h3-5,8-10H,2,6-7H2,1H3,(H2,18,20)(H,19,21)/t10-/m1/s1