2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-[(4-methylsulfonylphenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-[(4-methylsulfonylphenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]-4-piperidyl]-N-[(4-methylsulfonylphenyl)methyl]thiazole-4-carboxamide CAS Name: 2-[1-[[4-(dimethylamino)anilino]-sulfanylidenemethyl]-4-piperidinyl]-N-[(4-methylsulfonylphenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-[(4-methylsulfonylphenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[(4-dimethylaminophenyl)thiocarbamoyl]-4-piperidyl]-N-(4-mesylbenzyl)thiazole-4-carboxamide Formula: C26H31N5O3S3 MolecularWeight: 557.75104

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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)NCC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C26H31N5O3S3/c1-30(2)21-8-6-20(7-9-21)28-26(35)31-14-12-19(13-15-31)25-29-23(17-36-25)24(32)27-16-18-4-10-22(11-5-18)37(3,33)34/h4-11,17,19H,12-16H2,1-3H3,(H,27,32)(H,28,35)