[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-2-yl-methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-2-yl-methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-2-yl-methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-quinoxalinyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinoxalin-2-ylmethanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-quinoxalin-2-yl-methanone Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4N=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4N=C3)C

InChI

InChI=1S/C21H22N4O3S/c1-15-7-8-17(13-16(15)2)29(27,28)25-11-9-24(10-12-25)21(26)20-14-22-18-5-3-4-6-19(18)23-20/h3-8,13-14H,9-12H2,1-2H3