3-bromanyl-N-[(2-prop-2-enoxyphenyl)carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(2-prop-2-enoxyphenyl)carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[(2-allyloxyphenyl)carbamothioyl]-3-bromo-4-propoxy-benzamide CAS Name: 3-bromo-N-[(2-prop-2-enoxyanilino)-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[(2-prop-2-enoxyphenyl)carbamothioyl]-4-propoxybenzamide Traditional Name: N-[(2-allyloxyphenyl)thiocarbamoyl]-3-bromo-4-propoxy-benzamide Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC=C)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC=C)Br

InChI

InChI=1S/C20H21BrN2O3S/c1-3-11-25-17-10-9-14(13-15(17)21)19(24)23-20(27)22-16-7-5-6-8-18(16)26-12-4-2/h4-10,13H,2-3,11-12H2,1H3,(H2,22,23,24,27)