2-(3-azanylpropylcarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid

Systemtic Name: 2-(3-azanylpropylcarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid Openeye Name: 2-(3-aminopropylcarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid CAS Name: 2-[[(3-aminopropylamino)-oxomethyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid IUPAC Name: 2-(3-aminopropylcarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid Traditional Name: 2-(3-aminopropylcarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CO1)SC(=C2C(=O)O)NC(=O)NCCCN)C

Isomeric SMILES

CC1(CC2=C(CO1)SC(=C2C(=O)O)NC(=O)NCCCN)C

InChI

InChI=1S/C14H21N3O4S/c1-14(2)6-8-9(7-21-14)22-11(10(8)12(18)19)17-13(20)16-5-3-4-15/h3-7,15H2,1-2H3,(H,18,19)(H2,16,17,20)