3-chloranyl-4-methoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-chloranyl-4-methoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[5-(m-tolylmethylsulfonyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-chloro-4-methoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-chloro-4-methoxy-N-[5-(3-methylbenzyl)sulfonyl-1,3,4-thiadiazol-2-yl]benzamide Formula: C18H16ClN3O4S2 MolecularWeight: 437.92034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)C2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)C2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C18H16ClN3O4S2/c1-11-4-3-5-12(8-11)10-28(24,25)18-22-21-17(27-18)20-16(23)13-6-7-15(26-2)14(19)9-13/h3-9H,10H2,1-2H3,(H,20,21,23)