N2,N6-bis(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide

Systemtic Name: N2,N6-bis(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide Openeye Name: N2,N6-bis(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)pyridine-2,6-dicarboxamide CAS Name: N2,N6-bis(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide IUPAC Name: 2-N,6-N-bis(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,6-dicarboxamide Traditional Name: N,N'-bis(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)dipicolinamide Formula: C25H25N5O4S2 MolecularWeight: 523.6271

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N5O4S2/c26-20(31)18-12-6-1-3-10-16(12)35-24(18)29-22(33)14-8-5-9-15(28-14)23(34)30-25-19(21(27)32)13-7-2-4-11-17(13)36-25/h5,8-9H,1-4,6-7,10-11H2,(H2,26,31)(H2,27,32)(H,29,33)(H,30,34)