ethyl N-[1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: ethyl N-[1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: ethyl N-[1-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)-2-methyl-propyl]carbamate CAS Name: N-[1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)-2-methyl-propyl]carbamic acid ethyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C(C)C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCOC(=O)NC(C(C)C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H31N3O5S/c1-4-29-21(26)22-19(15(2)3)20(25)23-10-12-24(13-11-23)30(27,28)18-9-8-16-6-5-7-17(16)14-18/h8-9,14-15,19H,4-7,10-13H2,1-3H3,(H,22,26)