4-(3-methylbutoxy)-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-(3-methylbutoxy)-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-isopentyloxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-(3-methylbutoxy)-N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(3-methylbutoxy)-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-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=C(C=C2)OCCC(C)C

Isomeric SMILES

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

InChI

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