5-bromanyl-2-ethoxy-N-[(2-indol-1-ylethanoylamino)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[(2-indol-1-ylethanoylamino)carbamothioyl]benzamide Openeye Name: 5-bromo-2-ethoxy-N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]benzamide CAS Name: 5-bromo-2-ethoxy-N-[[[2-(1-indolyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-ethoxy-N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]benzamide Traditional Name: 5-bromo-2-ethoxy-N-[[(2-indol-1-ylacetyl)amino]thiocarbamoyl]benzamide Formula: C20H19BrN4O3S MolecularWeight: 475.35886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)CN2C=CC3=CC=CC=C32

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)CN2C=CC3=CC=CC=C32

InChI

InChI=1S/C20H19BrN4O3S/c1-2-28-17-8-7-14(21)11-15(17)19(27)22-20(29)24-23-18(26)12-25-10-9-13-5-3-4-6-16(13)25/h3-11H,2,12H2,1H3,(H,23,26)(H2,22,24,27,29)