2-[2-(2-hydroxyethylsulfanyl)ethanoylamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(2-hydroxyethylsulfanyl)ethanoylamino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-benzyl-2-[[2-(2-hydroxyethylsulfanyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(2-hydroxyethylthio)-1-oxoethyl]amino]-N-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-benzyl-2-[[2-(2-hydroxyethylsulfanyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-benzyl-2-[[2-(2-hydroxyethylthio)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CSCCO)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CSCCO)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O3S2/c23-10-11-26-13-17(24)22-20-18(15-8-4-5-9-16(15)27-20)19(25)21-12-14-6-2-1-3-7-14/h1-3,6-7,23H,4-5,8-13H2,(H,21,25)(H,22,24)