N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-6-methyl-2,3-dihydrobenzothiophene-2-carboxamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-6-methyl-2,3-dihydrobenzothiophene-2-carboxamide Formula: C18H18N2O2S2 MolecularWeight: 358.47772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)NC3=CC=CC=C3SCC(=O)N)C=C1

Isomeric SMILES

CC1=CC2=C(CC(S2)C(=O)NC3=CC=CC=C3SCC(=O)N)C=C1

InChI

InChI=1S/C18H18N2O2S2/c1-11-6-7-12-9-16(24-15(12)8-11)18(22)20-13-4-2-3-5-14(13)23-10-17(19)21/h2-8,16H,9-10H2,1H3,(H2,19,21)(H,20,22)