N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-benzylsulfonyl-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O3S2/c1-12(2)10-15-18-19-16(23-15)17-14(20)8-9-24(21,22)11-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,17,19,20)