S-[[3-(but-3-yn-2-ylamino)-2,3-dihydro-1H-inden-5-yl]] N,N-dimethylcarbamothioate

Systemtic Name: S-[[3-(but-3-yn-2-ylamino)-2,3-dihydro-1H-inden-5-yl]] N,N-dimethylcarbamothioate Openeye Name: S-[3-(1-methylprop-2-ynylamino)indan-5-yl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[[3-(but-3-yn-2-ylamino)-2,3-dihydro-1H-inden-5-yl]] ester IUPAC Name: S-[[3-(but-3-yn-2-ylamino)-2,3-dihydro-1H-inden-5-yl]] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[3-(1-methylprop-2-ynylamino)indan-5-yl] ester Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)NC1CCC2=C1C=C(C=C2)SC(=O)N(C)C

Isomeric SMILES

CC(C#C)NC1CCC2=C1C=C(C=C2)SC(=O)N(C)C

InChI

InChI=1S/C16H20N2OS/c1-5-11(2)17-15-9-7-12-6-8-13(10-14(12)15)20-16(19)18(3)4/h1,6,8,10-11,15,17H,7,9H2,2-4H3