4-butoxy-N-[(2-indol-1-ylethanoylamino)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(2-indol-1-ylethanoylamino)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[[2-(1-indolyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[[(2-indol-1-ylacetyl)amino]thiocarbamoyl]benzamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CN2C=CC3=CC=CC=C32

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CN2C=CC3=CC=CC=C32

InChI

InChI=1S/C22H24N4O3S/c1-2-3-14-29-18-10-8-17(9-11-18)21(28)23-22(30)25-24-20(27)15-26-13-12-16-6-4-5-7-19(16)26/h4-13H,2-3,14-15H2,1H3,(H,24,27)(H2,23,25,28,30)