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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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