[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] N-phenylpiperidine-1-carboximidothioate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] N-phenylpiperidine-1-carboximidothioate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] N-phenylpiperidine-1-carboximidothioate CAS Name: N-phenyl-1-piperidinecarboximidothioic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] N-phenylpiperidine-1-carboximidothioate Traditional Name: N-phenylpiperidine-1-carboximidothioic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC(=NC2=CC=CC=C2)N3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC(=NC2=CC=CC=C2)N3CCCCC3)C

InChI

InChI=1S/C22H27N3OS/c1-17-11-12-20(15-18(17)2)23-21(26)16-27-22(25-13-7-4-8-14-25)24-19-9-5-3-6-10-19/h3,5-6,9-12,15H,4,7-8,13-14,16H2,1-2H3,(H,23,26)