2-[1-(3,4-dimethylphenyl)sulfonylpiperidin-3-yl]-5-methyl-1,3,4-thiadiazole

Systemtic Name: 2-[1-(3,4-dimethylphenyl)sulfonylpiperidin-3-yl]-5-methyl-1,3,4-thiadiazole Openeye Name: 2-[1-(3,4-dimethylphenyl)sulfonyl-3-piperidyl]-5-methyl-1,3,4-thiadiazole CAS Name: 2-[1-(3,4-dimethylphenyl)sulfonyl-3-piperidinyl]-5-methyl-1,3,4-thiadiazole IUPAC Name: 2-[1-(3,4-dimethylphenyl)sulfonylpiperidin-3-yl]-5-methyl-1,3,4-thiadiazole Traditional Name: 2-[1-(3,4-dimethylphenyl)sulfonyl-3-piperidyl]-5-methyl-1,3,4-thiadiazole Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NN=C(S3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NN=C(S3)C)C

InChI

InChI=1S/C16H21N3O2S2/c1-11-6-7-15(9-12(11)2)23(20,21)19-8-4-5-14(10-19)16-18-17-13(3)22-16/h6-7,9,14H,4-5,8,10H2,1-3H3