2-chloranyl-N-[5-(4-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]-N-(2-methylpropyl)benzamide

Systemtic Name: 2-chloranyl-N-[5-(4-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]-N-(2-methylpropyl)benzamide Openeye Name: 2-chloro-N-[5-(4-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]-N-isobutyl-benzamide CAS Name: 2-chloro-N-[5-(4-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]-N-(2-methylpropyl)benzamide IUPAC Name: 2-chloro-N-[5-(4-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]-N-(2-methylpropyl)benzamide Traditional Name: 2-chloro-N-isobutyl-N-(5-p-phenetyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(S2)N(CC(C)C)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(S2)N(CC(C)C)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-4-27-16-11-9-15(10-12-16)19-23-24-21(28-19)25(13-14(2)3)20(26)17-7-5-6-8-18(17)22/h5-12,14H,4,13H2,1-3H3