N-[(3-butoxyphenyl)carbamothioyl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[(3-butoxyphenyl)carbamothioyl]-3-propan-2-yloxy-benzamide Openeye Name: N-[(3-butoxyphenyl)carbamothioyl]-3-isopropoxy-benzamide CAS Name: N-[(3-butoxyanilino)-sulfanylidenemethyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[(3-butoxyphenyl)carbamothioyl]-3-propan-2-yloxybenzamide Traditional Name: N-[(3-butoxyphenyl)thiocarbamoyl]-3-isopropoxy-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC(C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC(C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-5-12-25-18-10-7-9-17(14-18)22-21(27)23-20(24)16-8-6-11-19(13-16)26-15(2)3/h6-11,13-15H,4-5,12H2,1-3H3,(H2,22,23,24,27)