N2,N5-bis[3-aminocarbonyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-2,5-dicarboxamide

Systemtic Name: N2,N5-bis[3-aminocarbonyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-2,5-dicarboxamide Openeye Name: N2,N5-bis[3-carbamoyl-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyridine-2,5-dicarboxamide CAS Name: N2,N5-bis[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-2,5-dicarboxamide IUPAC Name: 2-N,5-N-bis[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-2,5-dicarboxamide Traditional Name: N,N'-bis(6-tert-amyl-3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)isocinchomeronamide 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=CN=C(C=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=CN=C(C=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)19-10-12-21-24(15-19)45-32(26(21)28(36)41)39-30(43)18-9-14-23(38-17-18)31(44)40-33-27(29(37)42)22-13-11-20(16-25(22)46-33)35(5,6)8-2/h9,14,17,19-20H,7-8,10-13,15-16H2,1-6H3,(H2,36,41)(H2,37,42)(H,39,43)(H,40,44)