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

Systemtic Name: N-(3-aminocarbonyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)piperazin-4-ium-1-carboxamide Openeye Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)piperazin-4-ium-1-carboxamide CAS Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)piperazin-4-ium-1-carboxamide Traditional Name: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)piperazin-4-ium-1-carboxamide Formula: C15H23N4O3S+ MolecularWeight: 339.43312

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CO1)SC(=C2C(=O)N)NC(=O)N3CC[NH2+]CC3)C

Isomeric SMILES

CC1(CC2=C(CO1)SC(=C2C(=O)N)NC(=O)N3CC[NH2+]CC3)C

InChI

InChI=1S/C15H22N4O3S/c1-15(2)7-9-10(8-22-15)23-13(11(9)12(16)20)18-14(21)19-5-3-17-4-6-19/h17H,3-8H2,1-2H3,(H2,16,20)(H,18,21)/p+1