methyl N-[(1S)-1-cyano-2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethyl]carbamate

Systemtic Name: methyl N-[(1S)-1-cyano-2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethyl]carbamate Openeye Name: methyl N-[(1S)-1-cyano-2-[1-(p-tolylsulfonyl)indol-3-yl]ethyl]carbamate CAS Name: N-[(1S)-1-cyano-2-[1-(4-methylphenyl)sulfonyl-3-indolyl]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(1S)-1-cyano-2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethyl]carbamate Traditional Name: N-[(1S)-1-cyano-2-(1-tosylindol-3-yl)ethyl]carbamic acid methyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC(C#N)NC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C[C@@H](C#N)NC(=O)OC

InChI

InChI=1S/C20H19N3O4S/c1-14-7-9-17(10-8-14)28(25,26)23-13-15(18-5-3-4-6-19(18)23)11-16(12-21)22-20(24)27-2/h3-10,13,16H,11H2,1-2H3,(H,22,24)/t16-/m0/s1