2-[2-[2-methylpropanoyl(thiophen-2-ylmethyl)amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[2-methylpropanoyl(thiophen-2-ylmethyl)amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-[2-methylpropanoyl(2-thienylmethyl)amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[(2-methyl-1-oxopropyl)-(thiophen-2-ylmethyl)amino]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-[2-methylpropanoyl(thiophen-2-ylmethyl)amino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-[isobutyryl(2-thenyl)amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(CC1=CC=CS1)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

Isomeric SMILES

CC(C)C(=O)N(CC1=CC=CS1)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

InChI

InChI=1S/C20H25N3O3S2/c1-12(2)20(26)23(10-13-6-5-9-27-13)11-16(24)22-19-17(18(21)25)14-7-3-4-8-15(14)28-19/h5-6,9,12H,3-4,7-8,10-11H2,1-2H3,(H2,21,25)(H,22,24)