N-[(2-indol-1-ylethanoylamino)carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[(2-indol-1-ylethanoylamino)carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-3-isobutoxy-benzamide CAS Name: N-[[[2-(1-indolyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[[(2-indol-1-ylacetyl)amino]thiocarbamoyl]-3-isobutoxy-benzamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CN2C=CC3=CC=CC=C32

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CN2C=CC3=CC=CC=C32

InChI

InChI=1S/C22H24N4O3S/c1-15(2)14-29-18-8-5-7-17(12-18)21(28)23-22(30)25-24-20(27)13-26-11-10-16-6-3-4-9-19(16)26/h3-12,15H,13-14H2,1-2H3,(H,24,27)(H2,23,25,28,30)