4-methyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)CC3=CC=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)CC3=CC=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H22N4O3S2/c1-15-9-10-17(14-18(15)30(27,28)25-11-5-6-12-25)20(26)22-21-24-23-19(29-21)13-16-7-3-2-4-8-16/h2-4,7-10,14H,5-6,11-13H2,1H3,(H,22,24,26)