S-[(Z)-[3-oxidanylidene-2-(1-oxidanylidene-3-phenyl-propan-2-yl)isoindol-1-ylidene]amino] carbamothioate

Systemtic Name: S-[(Z)-[3-oxidanylidene-2-(1-oxidanylidene-3-phenyl-propan-2-yl)isoindol-1-ylidene]amino] carbamothioate Openeye Name: S-[(Z)-[2-(1-benzyl-2-oxo-ethyl)-3-oxo-isoindolin-1-ylidene]amino] carbamothioate CAS Name: carbamothioic acid S-[(Z)-[3-oxo-2-(1-oxo-3-phenylpropan-2-yl)-1-isoindolylidene]amino] ester IUPAC Name: S-[(Z)-[3-oxo-2-(1-oxo-3-phenylpropan-2-yl)isoindol-1-ylidene]amino] carbamothioate Traditional Name: thiocarbamic acid S-[(Z)-[2-(1-benzyl-2-keto-ethyl)-3-keto-isoindolin-1-ylidene]amino] ester Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C=O)N2C(=NSC(=O)N)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)CC(C=O)N2/C(=N\SC(=O)N)/C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H15N3O3S/c19-18(24)25-20-16-14-8-4-5-9-15(14)17(23)21(16)13(11-22)10-12-6-2-1-3-7-12/h1-9,11,13H,10H2,(H2,19,24)/b20-16-