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

Systemtic Name: N-(4-dimethylaminophenyl)-4-[4-(3-phenoxyazetidin-1-yl)carbonyl-1,3-thiazol-2-yl]piperidine-1-carbothioamide Openeye Name: N-(4-dimethylaminophenyl)-4-[4-(3-phenoxyazetidine-1-carbonyl)thiazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(4-dimethylaminophenyl)-4-[4-[oxo-(3-phenoxy-1-azetidinyl)methyl]-2-thiazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(4-dimethylaminophenyl)-4-[4-(3-phenoxyazetidine-1-carbonyl)-1,3-thiazol-2-yl]piperidine-1-carbothioamide Traditional Name: N-(4-dimethylaminophenyl)-4-[4-(3-phenoxyazetidine-1-carbonyl)thiazol-2-yl]piperidine-1-carbothioamide Formula: C27H31N5O2S2 MolecularWeight: 521.69734

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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)N4CC(C4)OC5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)N4CC(C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H31N5O2S2/c1-30(2)21-10-8-20(9-11-21)28-27(35)31-14-12-19(13-15-31)25-29-24(18-36-25)26(33)32-16-23(17-32)34-22-6-4-3-5-7-22/h3-11,18-19,23H,12-17H2,1-2H3,(H,28,35)