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

Systemtic Name: N-[(2-indol-1-ylethanoylamino)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[[2-(1-indolyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[[(2-indol-1-ylacetyl)amino]thiocarbamoyl]-4-isopropyl-benzamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O2S/c1-14(2)15-7-9-17(10-8-15)20(27)22-21(28)24-23-19(26)13-25-12-11-16-5-3-4-6-18(16)25/h3-12,14H,13H2,1-2H3,(H,23,26)(H2,22,24,27,28)