N-[4-(diethylcarbamoyl)phenyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[4-(diethylcarbamoyl)phenyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[4-(diethylcarbamoyl)phenyl]benzamide CAS Name: N-[4-[diethylamino(oxo)methyl]phenyl]-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[4-(diethylcarbamoyl)phenyl]benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-[4-(diethylcarbamoyl)phenyl]benzamide Formula: C29H34N4O4S MolecularWeight: 534.66966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C29H34N4O4S/c1-3-32(4-2)29(35)24-13-15-26(16-14-24)30-28(34)25-11-8-12-27(21-25)38(36,37)33-19-17-31(18-20-33)22-23-9-6-5-7-10-23/h5-16,21H,3-4,17-20,22H2,1-2H3,(H,30,34)