N-(3-aminocarbonyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-4-(2-methylprop-2-enyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3-aminocarbonyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-4-(2-methylprop-2-enyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-4-(2-methylallyl)piperazin-4-ium-1-carboxamide CAS Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-4-(2-methylprop-2-enyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-4-(2-methylprop-2-enyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-4-(2-methylallyl)piperazin-4-ium-1-carboxamide Formula: C19H29N4O3S+ MolecularWeight: 393.52356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[NH+]1CCN(CC1)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N

Isomeric SMILES

CC(=C)C[NH+]1CCN(CC1)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N

InChI

InChI=1S/C19H28N4O3S/c1-12(2)10-22-5-7-23(8-6-22)18(25)21-17-15(16(20)24)13-9-19(3,4)26-11-14(13)27-17/h1,5-11H2,2-4H3,(H2,20,24)(H,21,25)/p+1