3-bromanyl-N-[(4-heptoxyphenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: 3-bromanyl-N-[(4-heptoxyphenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[(4-heptoxyphenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[(4-heptoxyanilino)-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[(4-heptoxyphenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[(4-heptoxyphenyl)thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C24H31BrN2O4S MolecularWeight: 523.48294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

InChI

InChI=1S/C24H31BrN2O4S/c1-3-4-5-6-7-14-30-20-11-9-19(10-12-20)26-24(32)27-23(28)18-8-13-22(21(25)17-18)31-16-15-29-2/h8-13,17H,3-7,14-16H2,1-2H3,(H2,26,27,28,32)