S-[(2S)-1-phenylazanyl-1-(phenylsulfonylimino)propan-2-yl] carbamothioate

Systemtic Name: S-[(2S)-1-phenylazanyl-1-(phenylsulfonylimino)propan-2-yl] carbamothioate Openeye Name: S-[(1S)-2-anilino-2-(benzenesulfonylimino)-1-methyl-ethyl] carbamothioate CAS Name: carbamothioic acid S-[(2S)-1-anilino-1-(benzenesulfonylimino)propan-2-yl] ester IUPAC Name: S-[(2S)-1-anilino-1-(benzenesulfonylimino)propan-2-yl] carbamothioate Traditional Name: thiocarbamic acid S-[(1S)-2-anilino-2-besylimino-1-methyl-ethyl] ester Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=NS(=O)(=O)C1=CC=CC=C1)NC2=CC=CC=C2)SC(=O)N

Isomeric SMILES

C[C@@H](C(=NS(=O)(=O)C1=CC=CC=C1)NC2=CC=CC=C2)SC(=O)N

InChI

InChI=1S/C16H17N3O3S2/c1-12(23-16(17)20)15(18-13-8-4-2-5-9-13)19-24(21,22)14-10-6-3-7-11-14/h2-12H,1H3,(H2,17,20)(H,18,19)/t12-/m0/s1