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

Systemtic Name: N-(4-butylphenyl)-3-methoxy-benzenecarbothioamide Openeye Name: N-(4-butylphenyl)-3-methoxy-benzenecarbothioamide CAS Name: N-(4-butylphenyl)-3-methoxybenzenecarbothioamide IUPAC Name: N-(4-butylphenyl)-3-methoxybenzenecarbothioamide Traditional Name: N-(4-butylphenyl)-3-methoxy-thiobenzamide Formula: C18H21NOS MolecularWeight: 299.43044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NOS/c1-3-4-6-14-9-11-16(12-10-14)19-18(21)15-7-5-8-17(13-15)20-2/h5,7-13H,3-4,6H2,1-2H3,(H,19,21)