2-[[2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]ethyl N-cyclopropylcarbamodithioate

Systemtic Name: 2-[[2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]ethyl N-cyclopropylcarbamodithioate Openeye Name: 2-[[2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]thiazole-4-carbonyl]amino]ethyl N-cyclopropylcarbamodithioate CAS Name: N-cyclopropylcarbamodithioic acid 2-[[oxo-[2-[1-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-4-piperidinyl]-4-thiazolyl]methyl]amino]ethyl ester IUPAC Name: 2-[[2-[1-(4-pyridin-2-ylpiperazine-1-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]ethyl N-cyclopropylcarbamodithioate Traditional Name: N-cyclopropylcarbamodithioic acid 2-[[2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]thiazole-4-carbonyl]amino]ethyl ester Formula: C25H33N7O2S3 MolecularWeight: 559.77022

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)SCCNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C1CC1NC(=S)SCCNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C25H33N7O2S3/c33-22(27-9-16-36-24(35)28-19-4-5-19)20-17-37-23(29-20)18-6-10-31(11-7-18)25(34)32-14-12-30(13-15-32)21-3-1-2-8-26-21/h1-3,8,17-19H,4-7,9-16H2,(H,27,33)(H,28,35)