N-[(4-heptoxyphenyl)carbamothioyl]-4-methyl-benzamide

Systemtic Name: N-[(4-heptoxyphenyl)carbamothioyl]-4-methyl-benzamide Openeye Name: N-[(4-heptoxyphenyl)carbamothioyl]-4-methyl-benzamide CAS Name: N-[(4-heptoxyanilino)-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[(4-heptoxyphenyl)carbamothioyl]-4-methylbenzamide Traditional Name: N-[(4-heptoxyphenyl)thiocarbamoyl]-4-methyl-benzamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H28N2O2S/c1-3-4-5-6-7-16-26-20-14-12-19(13-15-20)23-22(27)24-21(25)18-10-8-17(2)9-11-18/h8-15H,3-7,16H2,1-2H3,(H2,23,24,25,27)