N1,N2-bis(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,2-dicarboxamide

Systemtic Name: N1,N2-bis(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,2-dicarboxamide Openeye Name: N1,N2-bis(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)phthalamide CAS Name: N1,N2-bis(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,2-dicarboxamide IUPAC Name: 1-N,2-N-bis(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzene-1,2-dicarboxamide Traditional Name: N,N'-bis(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)phthalamide Formula: C26H26N4O4S2 MolecularWeight: 522.63904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)N)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)N)C(=O)N

InChI

InChI=1S/C26H26N4O4S2/c27-21(31)19-15-9-3-5-11-17(15)35-25(19)29-23(33)13-7-1-2-8-14(13)24(34)30-26-20(22(28)32)16-10-4-6-12-18(16)36-26/h1-2,7-8H,3-6,9-12H2,(H2,27,31)(H2,28,32)(H,29,33)(H,30,34)