N-[(4-heptoxyphenyl)carbamothioyl]-2-methyl-benzamide

Systemtic Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-methyl-benzamide Openeye Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-methyl-benzamide CAS Name: N-[(4-heptoxyanilino)-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-methylbenzamide Traditional Name: N-[(4-heptoxyphenyl)thiocarbamoyl]-2-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=CC=C2C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C22H28N2O2S/c1-3-4-5-6-9-16-26-19-14-12-18(13-15-19)23-22(27)24-21(25)20-11-8-7-10-17(20)2/h7-8,10-15H,3-6,9,16H2,1-2H3,(H2,23,24,25,27)