2-(4-methoxyphenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-methoxyphenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]thiazole-4-carboxamide CAS Name: 2-(4-methoxyphenyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-4-thiazolecarboxamide IUPAC Name: 2-(4-methoxyphenyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2-(4-methoxyphenyl)thiazole-4-carboxamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C20H19N5O3S/c1-28-15-5-2-13(3-6-15)20-24-16(12-29-20)19(27)23-14-4-7-17(22-10-14)25-9-8-21-18(26)11-25/h2-7,10,12H,8-9,11H2,1H3,(H,21,26)(H,23,27)