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

Systemtic Name: N2,N6-bis[3-aminocarbonyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-2,6-dicarboxamide Openeye Name: N2,N6-bis[3-carbamoyl-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyridine-2,6-dicarboxamide CAS Name: N2,N6-bis[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-2,6-dicarboxamide IUPAC Name: 2-N,6-N-bis[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-2,6-dicarboxamide Traditional Name: N,N'-bis(6-tert-amyl-3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)dipicolinamide Formula: C35H45N5O4S2 MolecularWeight: 663.8929

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=NC(=CC=C3)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)CC)C(=O)N

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=NC(=CC=C3)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)CC)C(=O)N

InChI

InChI=1S/C35H45N5O4S2/c1-7-34(3,4)18-12-14-20-24(16-18)45-32(26(20)28(36)41)39-30(43)22-10-9-11-23(38-22)31(44)40-33-27(29(37)42)21-15-13-19(17-25(21)46-33)35(5,6)8-2/h9-11,18-19H,7-8,12-17H2,1-6H3,(H2,36,41)(H2,37,42)(H,39,43)(H,40,44)