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

Systemtic Name: N-[(4-heptoxyphenyl)carbamothioyl]-4-methoxy-benzamide Openeye Name: N-[(4-heptoxyphenyl)carbamothioyl]-4-methoxy-benzamide CAS Name: N-[(4-heptoxyanilino)-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: N-[(4-heptoxyphenyl)carbamothioyl]-4-methoxybenzamide Traditional Name: N-[(4-heptoxyphenyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3S/c1-3-4-5-6-7-16-27-20-14-10-18(11-15-20)23-22(28)24-21(25)17-8-12-19(26-2)13-9-17/h8-15H,3-7,16H2,1-2H3,(H2,23,24,25,28)