4-[2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanylethanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanylethanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-[[2-[2-oxo-2-(1-piperidyl)ethyl]sulfanylacetyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[1-oxo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]ethyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-[[2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetyl]amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-[[2-[(2-keto-2-piperidino-ethyl)thio]acetyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C17H21N5O3S2 MolecularWeight: 407.51034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)N

Isomeric SMILES

C1CCN(CC1)C(=O)CSCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)N

InChI

InChI=1S/C17H21N5O3S2/c18-16(25)12-6-11(7-19-12)13-8-27-17(20-13)21-14(23)9-26-10-15(24)22-4-2-1-3-5-22/h6-8,19H,1-5,9-10H2,(H2,18,25)(H,20,21,23)