N-[(4-butylphenyl)carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[(4-butylphenyl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(4-butylphenyl)carbamothioyl]benzamide CAS Name: N-[(4-butylanilino)-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(4-butylphenyl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(4-butylphenyl)thiocarbamoyl]benzamide Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O2S/c1-2-3-8-19-13-15-22(16-14-19)26-25(30)27-24(28)21-11-7-12-23(17-21)29-18-20-9-5-4-6-10-20/h4-7,9-17H,2-3,8,18H2,1H3,(H2,26,27,28,30)