3-(3-methylbutoxy)-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-(3-methylbutoxy)-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-isopentyloxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 3-(3-methylbutoxy)-N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(3-methylbutoxy)-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-isoamoxy-N-[[(2-propoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

InChI

InChI=1S/C23H29N3O4S/c1-4-13-30-20-11-6-5-10-19(20)22(28)25-26-23(31)24-21(27)17-8-7-9-18(15-17)29-14-12-16(2)3/h5-11,15-16H,4,12-14H2,1-3H3,(H,25,28)(H2,24,26,27,31)