N-(4-dimethylaminophenyl)-4-[4-[(2-phenoxyethanoylamino)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(4-dimethylaminophenyl)-4-[4-[(2-phenoxyethanoylamino)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carbothioamide Openeye Name: N-(4-dimethylaminophenyl)-4-[4-[[(2-phenoxyacetyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(4-dimethylaminophenyl)-4-[4-[oxo-[(1-oxo-2-phenoxyethyl)hydrazo]methyl]-2-thiazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(4-dimethylaminophenyl)-4-[4-[[(2-phenoxyacetyl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carbothioamide Traditional Name: N-(4-dimethylaminophenyl)-4-[4-[[(2-phenoxyacetyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carbothioamide Formula: C26H30N6O3S2 MolecularWeight: 538.6848

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)NNC(=O)COC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)NNC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C26H30N6O3S2/c1-31(2)20-10-8-19(9-11-20)27-26(36)32-14-12-18(13-15-32)25-28-22(17-37-25)24(34)30-29-23(33)16-35-21-6-4-3-5-7-21/h3-11,17-18H,12-16H2,1-2H3,(H,27,36)(H,29,33)(H,30,34)