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

Systemtic Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-ethyl-N-(phenylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-benzyl-2-[1-[(4-dimethylaminophenyl)carbamothioyl]-4-piperidyl]-N-ethyl-thiazole-4-carboxamide CAS Name: 2-[1-[[4-(dimethylamino)anilino]-sulfanylidenemethyl]-4-piperidinyl]-N-ethyl-N-(phenylmethyl)-4-thiazolecarboxamide IUPAC Name: N-benzyl-2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-ethyl-1,3-thiazole-4-carboxamide Traditional Name: N-benzyl-2-[1-[(4-dimethylaminophenyl)thiocarbamoyl]-4-piperidyl]-N-ethyl-thiazole-4-carboxamide Formula: C27H33N5OS2 MolecularWeight: 507.71382

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=S)NC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=S)NC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H33N5OS2/c1-4-31(18-20-8-6-5-7-9-20)26(33)24-19-35-25(29-24)21-14-16-32(17-15-21)27(34)28-22-10-12-23(13-11-22)30(2)3/h5-13,19,21H,4,14-18H2,1-3H3,(H,28,34)