3-butoxy-N-[(2-propan-2-yloxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(2-propan-2-yloxyphenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(2-isopropoxyphenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(2-propan-2-yloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(2-propan-2-yloxyphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(2-isopropoxyphenyl)thiocarbamoyl]benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2OC(C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2OC(C)C

InChI

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