5-[(2-methoxyphenyl)methylamino]-N-(5-piperazin-1-ylpyridin-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 5-[(2-methoxyphenyl)methylamino]-N-(5-piperazin-1-ylpyridin-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 5-[(2-methoxyphenyl)methylamino]-N-(5-piperazin-1-yl-2-pyridyl)thiazole-4-carboxamide CAS Name: 5-[(2-methoxyphenyl)methylamino]-N-[5-(1-piperazinyl)-2-pyridinyl]-4-thiazolecarboxamide IUPAC Name: 5-[(2-methoxyphenyl)methylamino]-N-(5-piperazin-1-ylpyridin-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 5-(o-anisylamino)-N-(5-piperazino-2-pyridyl)thiazole-4-carboxamide Formula: C21H24N6O2S MolecularWeight: 424.51926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC2=C(N=CS2)C(=O)NC3=NC=C(C=C3)N4CCNCC4

Isomeric SMILES

COC1=CC=CC=C1CNC2=C(N=CS2)C(=O)NC3=NC=C(C=C3)N4CCNCC4

InChI

InChI=1S/C21H24N6O2S/c1-29-17-5-3-2-4-15(17)12-24-21-19(25-14-30-21)20(28)26-18-7-6-16(13-23-18)27-10-8-22-9-11-27/h2-7,13-14,22,24H,8-12H2,1H3,(H,23,26,28)