N-[5-(diethylamino)pentan-2-ylcarbamothioyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[5-(diethylamino)pentan-2-ylcarbamothioyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[[4-(diethylamino)-1-methyl-butyl]carbamothioyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[[5-(diethylamino)pentan-2-ylamino]-sulfanylidenemethyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[5-(diethylamino)pentan-2-ylcarbamothioyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[[4-(diethylamino)-1-methyl-butyl]thiocarbamoyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C22H36N4O4S2 MolecularWeight: 484.67564

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=S)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)C

Isomeric SMILES

CCN(CC)CCCC(C)NC(=S)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)C

InChI

InChI=1S/C22H36N4O4S2/c1-5-25(6-2)11-7-8-18(4)23-22(31)24-21(27)20-16-19(10-9-17(20)3)32(28,29)26-12-14-30-15-13-26/h9-10,16,18H,5-8,11-15H2,1-4H3,(H2,23,24,27,31)