(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone

Systemtic Name: (4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone Openeye Name: [4-(2-naphthylsulfonyl)piperazin-1-yl]-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone CAS Name: [4-(2-naphthalenylsulfonyl)-1-piperazinyl]-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone IUPAC Name: (4-naphthalen-2-ylsulfonylpiperazin-1-yl)-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone Traditional Name: [4-(2-naphthylsulfonyl)piperazino]-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methanone Formula: C24H23N5O3S MolecularWeight: 461.53612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)CN3C=NC=N3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)CN3C=NC=N3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H23N5O3S/c30-24(21-7-5-19(6-8-21)16-28-18-25-17-26-28)27-11-13-29(14-12-27)33(31,32)23-10-9-20-3-1-2-4-22(20)15-23/h1-10,15,17-18H,11-14,16H2