N-(4-butylphenyl)-3-methyl-benzenecarbothioamide

Systemtic Name: N-(4-butylphenyl)-3-methyl-benzenecarbothioamide Openeye Name: N-(4-butylphenyl)-3-methyl-benzenecarbothioamide CAS Name: N-(4-butylphenyl)-3-methylbenzenecarbothioamide IUPAC Name: N-(4-butylphenyl)-3-methylbenzenecarbothioamide Traditional Name: N-(4-butylphenyl)-3-methyl-thiobenzamide Formula: C18H21NS MolecularWeight: 283.43104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)C2=CC(=CC=C2)C

InChI

InChI=1S/C18H21NS/c1-3-4-7-15-9-11-17(12-10-15)19-18(20)16-8-5-6-14(2)13-16/h5-6,8-13H,3-4,7H2,1-2H3,(H,19,20)