N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S/c21-17(19-10-13-6-2-1-3-7-13)11-20-18(22)15-12-23-16-9-5-4-8-14(15)16/h1-3,6-7,12H,4-5,8-11H2,(H,19,21)(H,20,22)