N,N'-bis[3-aminocarbonyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pentanediamide

Systemtic Name: N,N'-bis[3-aminocarbonyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pentanediamide Openeye Name: N,N'-bis[3-carbamoyl-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]pentanediamide CAS Name: N,N'-bis[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pentanediamide IUPAC Name: N,N'-bis[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pentanediamide Traditional Name: N,N'-bis(6-tert-amyl-3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)glutaramide Formula: C33H48N4O4S2 MolecularWeight: 628.88862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCC(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)CC)C(=O)N

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCC(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)CC)C(=O)N

InChI

InChI=1S/C33H48N4O4S2/c1-7-32(3,4)18-12-14-20-22(16-18)42-30(26(20)28(34)40)36-24(38)10-9-11-25(39)37-31-27(29(35)41)21-15-13-19(17-23(21)43-31)33(5,6)8-2/h18-19H,7-17H2,1-6H3,(H2,34,40)(H2,35,41)(H,36,38)(H,37,39)