N1,N3-bis(3-aminocarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis(3-aminocarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzene-1,3-dicarboxamide Traditional Name: N,N'-bis(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)isophthalamide Formula: C28H30N4O4S2 MolecularWeight: 550.6922

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=CC(=CC=C3)C(=O)NC4=C(C5=C(S4)CCCCC5)C(=O)N

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=CC(=CC=C3)C(=O)NC4=C(C5=C(S4)CCCCC5)C(=O)N

InChI

InChI=1S/C28H30N4O4S2/c29-23(33)21-17-10-3-1-5-12-19(17)37-27(21)31-25(35)15-8-7-9-16(14-15)26(36)32-28-22(24(30)34)18-11-4-2-6-13-20(18)38-28/h7-9,14H,1-6,10-13H2,(H2,29,33)(H2,30,34)(H,31,35)(H,32,36)