N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-3-(prop-2-ynylsulfamoyl)benzamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-3-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-3-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-3-(propargylsulfamoyl)benzamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O3S/c1-2-15-28-35(33,34)26-10-6-9-23(20-26)27(32)29-24-11-13-25(14-12-24)31-18-16-30(17-19-31)21-22-7-4-3-5-8-22/h1,3-14,20,28H,15-19,21H2,(H,29,32)