2,6-diethyl-N-[5-(3-methylhexan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide

Systemtic Name: 2,6-diethyl-N-[5-(3-methylhexan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide Openeye Name: 2,6-diethyl-N-[5-(1-ethyl-1-methyl-butyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide CAS Name: 2,6-diethyl-N-[5-(3-methylhexan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide IUPAC Name: 2,6-diethyl-N-[5-(3-methylhexan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide Traditional Name: 2,6-diethyl-N-[5-(1-ethyl-1-methyl-butyl)-1,3,4-thiadiazol-2-yl]thiobenzamide Formula: C20H29N3S2 MolecularWeight: 375.59436

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CC)C1=NN=C(S1)NC(=S)C2=C(C=CC=C2CC)CC

Isomeric SMILES

CCCC(C)(CC)C1=NN=C(S1)NC(=S)C2=C(C=CC=C2CC)CC

InChI

InChI=1S/C20H29N3S2/c1-6-13-20(5,9-4)18-22-23-19(25-18)21-17(24)16-14(7-2)11-10-12-15(16)8-3/h10-12H,6-9,13H2,1-5H3,(H,21,23,24)