N-[(2-indol-1-ylethanoylamino)carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[(2-indol-1-ylethanoylamino)carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[[2-(1-indolyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[[(2-indol-1-ylacetyl)amino]thiocarbamoyl]-3-phenyl-propionamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O2S/c25-18(11-10-15-6-2-1-3-7-15)21-20(27)23-22-19(26)14-24-13-12-16-8-4-5-9-17(16)24/h1-9,12-13H,10-11,14H2,(H,22,26)(H2,21,23,25,27)