2-[[4-[1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]oxyphenyl]carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[[4-[1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]oxyphenyl]carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[4-[2-(4-bromoanilino)-1-methyl-2-oxo-ethoxy]benzoyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[[4-[1-(4-bromoanilino)-1-oxopropan-2-yl]oxyphenyl]-oxomethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[4-[1-(4-bromoanilino)-1-oxopropan-2-yl]oxybenzoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[4-[2-(4-bromoanilino)-2-keto-1-methyl-ethoxy]benzoyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C26H26BrN3O4S MolecularWeight: 556.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC=C(C=C3)OC(C)C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC=C(C=C3)OC(C)C(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C26H26BrN3O4S/c1-14-3-12-20-21(13-14)35-26(22(20)23(28)31)30-25(33)16-4-10-19(11-5-16)34-15(2)24(32)29-18-8-6-17(27)7-9-18/h4-11,14-15H,3,12-13H2,1-2H3,(H2,28,31)(H,29,32)(H,30,33)