N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-2-(4-fluorophenyl)-4-methyl-5-thiazolecarboxamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxamide Formula: C21H18ClFN4O2S MolecularWeight: 444.909623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

InChI

InChI=1S/C21H18ClFN4O2S/c1-12-19(30-21(25-12)13-2-4-14(23)5-3-13)20(29)26-15-6-7-17(16(22)10-15)27-9-8-24-18(28)11-27/h2-7,10H,8-9,11H2,1H3,(H,24,28)(H,26,29)