4-bromanyl-N-[3-chloranyl-2-(4-prop-2-enylpiperazin-1-yl)phenyl]-1,3-thiazole-2-carboxamide

Systemtic Name: 4-bromanyl-N-[3-chloranyl-2-(4-prop-2-enylpiperazin-1-yl)phenyl]-1,3-thiazole-2-carboxamide Openeye Name: N-[2-(4-allylpiperazin-1-yl)-3-chloro-phenyl]-4-bromo-thiazole-2-carboxamide CAS Name: 4-bromo-N-[3-chloro-2-(4-prop-2-enyl-1-piperazinyl)phenyl]-2-thiazolecarboxamide IUPAC Name: 4-bromo-N-[3-chloro-2-(4-prop-2-enylpiperazin-1-yl)phenyl]-1,3-thiazole-2-carboxamide Traditional Name: N-[2-(4-allylpiperazino)-3-chloro-phenyl]-4-bromo-thiazole-2-carboxamide Formula: C17H18BrClN4OS MolecularWeight: 441.77302

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=NC(=CS3)Br

Isomeric SMILES

C=CCN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=NC(=CS3)Br

InChI

InChI=1S/C17H18BrClN4OS/c1-2-6-22-7-9-23(10-8-22)15-12(19)4-3-5-13(15)20-16(24)17-21-14(18)11-25-17/h2-5,11H,1,6-10H2,(H,20,24)