N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]-3-(3-methylbutoxy)benzamide

Systemtic Name: N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]-3-isopentyloxy-benzamide CAS Name: N-[[[2-(4-chlorophenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[[[2-(4-chlorophenyl)acetyl]amino]thiocarbamoyl]-3-isoamoxy-benzamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClN3O3S/c1-14(2)10-11-28-18-5-3-4-16(13-18)20(27)23-21(29)25-24-19(26)12-15-6-8-17(22)9-7-15/h3-9,13-14H,10-12H2,1-2H3,(H,24,26)(H2,23,25,27,29)