S-[2-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl] pyridine-4-carbothioate

Systemtic Name: S-[2-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl] pyridine-4-carbothioate Openeye Name: S-[2-[[(1R)-2-amino-1-methyl-2-oxo-ethyl]carbamoyl]phenyl] pyridine-4-carbothioate CAS Name: 4-pyridinecarbothioic acid S-[2-[[[(2R)-1-amino-1-oxopropan-2-yl]amino]-oxomethyl]phenyl] ester IUPAC Name: S-[2-[[(2R)-1-amino-1-oxopropan-2-yl]carbamoyl]phenyl] pyridine-4-carbothioate Traditional Name: pyridine-4-carbothioic acid S-[2-[[(1R)-2-amino-2-keto-1-methyl-ethyl]carbamoyl]phenyl] ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C1=CC=CC=C1SC(=O)C2=CC=NC=C2

Isomeric SMILES

C[C@H](C(=O)N)NC(=O)C1=CC=CC=C1SC(=O)C2=CC=NC=C2

InChI

InChI=1S/C16H15N3O3S/c1-10(14(17)20)19-15(21)12-4-2-3-5-13(12)23-16(22)11-6-8-18-9-7-11/h2-10H,1H3,(H2,17,20)(H,19,21)/t10-/m1/s1