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

Systemtic Name: N-[(2-indol-1-ylethanoylamino)carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-3-isopentyloxy-benzamide CAS Name: N-[[[2-(1-indolyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[[(2-indol-1-ylacetyl)amino]carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[[(2-indol-1-ylacetyl)amino]thiocarbamoyl]-3-isoamoxy-benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O3S/c1-16(2)11-13-30-19-8-5-7-18(14-19)22(29)24-23(31)26-25-21(28)15-27-12-10-17-6-3-4-9-20(17)27/h3-10,12,14,16H,11,13,15H2,1-2H3,(H,25,28)(H2,24,26,29,31)