3-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoylamino]propyl-dimethyl-azanium Openeye Name: 3-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoylamino]propyl-dimethylazanium Traditional Name: 3-[(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoylamino]propyl-dimethyl-ammonium Formula: C16H25N4O2S+ MolecularWeight: 337.4603

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CO1)SC(=C2C#N)NC(=O)NCCC[NH+](C)C)C

Isomeric SMILES

CC1(CC2=C(CO1)SC(=C2C#N)NC(=O)NCCC[NH+](C)C)C

InChI

InChI=1S/C16H24N4O2S/c1-16(2)8-11-12(9-17)14(23-13(11)10-22-16)19-15(21)18-6-5-7-20(3)4/h5-8,10H2,1-4H3,(H2,18,19,21)/p+1