N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]-4-chloranyl-benzamide

Systemtic Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]-4-chloranyl-benzamide Openeye Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]thiazol-2-yl]-4-chloro-benzamide CAS Name: N-[4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-2-thiazolyl]-4-chlorobenzamide IUPAC Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl]-4-chlorobenzamide Traditional Name: 4-chloro-N-[4-(4-piperonylpiperazine-1-carbonyl)thiazol-2-yl]benzamide Formula: C23H21ClN4O4S MolecularWeight: 484.95524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CSC(=N4)NC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CSC(=N4)NC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H21ClN4O4S/c24-17-4-2-16(3-5-17)21(29)26-23-25-18(13-33-23)22(30)28-9-7-27(8-10-28)12-15-1-6-19-20(11-15)32-14-31-19/h1-6,11,13H,7-10,12,14H2,(H,25,26,29)