N-[[2-(2-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[2-(2-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-3-propoxy-benzamide Openeye Name: 3-propoxy-N-[[[2-(2-sec-butylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: N-[[[2-(2-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[[2-(2-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-3-propoxybenzamide Traditional Name: 3-propoxy-N-[[[2-(2-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2C(C)CC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2C(C)CC

InChI

InChI=1S/C23H29N3O4S/c1-4-13-29-18-10-8-9-17(14-18)22(28)24-23(31)26-25-21(27)15-30-20-12-7-6-11-19(20)16(3)5-2/h6-12,14,16H,4-5,13,15H2,1-3H3,(H,25,27)(H2,24,26,28,31)