S-[2-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl] 2-(trifluoromethyl)benzenecarbothioate

Systemtic Name: S-[2-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl] 2-(trifluoromethyl)benzenecarbothioate Openeye Name: S-[2-[(2-amino-2-oxo-ethyl)carbamoyl]phenyl] 2-(trifluoromethyl)benzenecarbothioate CAS Name: 2-(trifluoromethyl)benzenecarbothioic acid S-[2-[[(2-amino-2-oxoethyl)amino]-oxomethyl]phenyl] ester IUPAC Name: S-[2-[(2-amino-2-oxoethyl)carbamoyl]phenyl] 2-(trifluoromethyl)benzenecarbothioate Traditional Name: 2-(trifluoromethyl)thiobenzoic acid S-[2-[(2-amino-2-keto-ethyl)carbamoyl]phenyl] ester Formula: C17H13F3N2O3S MolecularWeight: 382.35693

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)SC2=CC=CC=C2C(=O)NCC(=O)N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)SC2=CC=CC=C2C(=O)NCC(=O)N)C(F)(F)F

InChI

InChI=1S/C17H13F3N2O3S/c18-17(19,20)12-7-3-1-5-10(12)16(25)26-13-8-4-2-6-11(13)15(24)22-9-14(21)23/h1-8H,9H2,(H2,21,23)(H,22,24)