N-(3-methoxypropyl)-2-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(3-methoxypropyl)-2-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-methoxypropyl)-2-[(4-propoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-methoxypropyl)-2-[[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-methoxypropyl)-2-[(4-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(3-methoxypropyl)-2-[(4-propoxybenzoyl)thiocarbamoylamino]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCOC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCOC

InChI

InChI=1S/C22H27N3O4S/c1-3-14-29-17-11-9-16(10-12-17)20(26)25-22(30)24-19-8-5-4-7-18(19)21(27)23-13-6-15-28-2/h4-5,7-12H,3,6,13-15H2,1-2H3,(H,23,27)(H2,24,25,26,30)