6-tert-butyl-2-[[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-tert-butyl-2-[[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-tert-butyl-2-[[4-(4-methyl-1-piperidyl)-3-nitro-benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-tert-butyl-2-[[[4-(4-methyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-tert-butyl-2-[[4-(4-methylpiperidin-1-yl)-3-nitrobenzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-tert-butyl-2-[[4-(4-methylpiperidino)-3-nitro-benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C26H34N4O4S MolecularWeight: 498.63756

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C26H34N4O4S/c1-15-9-11-29(12-10-15)19-8-5-16(13-20(19)30(33)34)24(32)28-25-22(23(27)31)18-7-6-17(26(2,3)4)14-21(18)35-25/h5,8,13,15,17H,6-7,9-12,14H2,1-4H3,(H2,27,31)(H,28,32)