N-tert-butyl-2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-tert-butyl-2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-tert-butyl-2-chloro-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-tert-butyl-2-chloro-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-tert-butyl-2-chloro-5-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-tert-butyl-2-chloro-5-(4-phenylpiperazino)sulfonyl-benzamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H26ClN3O3S/c1-21(2,3)23-20(26)18-15-17(9-10-19(18)22)29(27,28)25-13-11-24(12-14-25)16-7-5-4-6-8-16/h4-10,15H,11-14H2,1-3H3,(H,23,26)