3-methyl-N-[5-[4-(2-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 3-methyl-N-[5-[4-(2-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 3-methyl-N-[5-[4-(o-tolyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 3-methyl-N-[5-[[4-(2-methylphenyl)-1-piperazinyl]sulfonyl]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 3-methyl-N-[5-[4-(2-methylphenyl)piperazin-1-yl]sulfonyl-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 3-methyl-N-[5-[4-(o-tolyl)piperazino]sulfonyl-1,3,4-thiadiazol-2-yl]butyramide Formula: C18H25N5O3S2 MolecularWeight: 423.5528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=NN=C(S3)NC(=O)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=NN=C(S3)NC(=O)CC(C)C

InChI

InChI=1S/C18H25N5O3S2/c1-13(2)12-16(24)19-17-20-21-18(27-17)28(25,26)23-10-8-22(9-11-23)15-7-5-4-6-14(15)3/h4-7,13H,8-12H2,1-3H3,(H,19,20,24)