N-propan-2-yl-2-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-propan-2-yl-2-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-isopropyl-2-[(4-propoxybenzoyl)carbamothioylamino]benzamide CAS Name: 2-[[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: N-propan-2-yl-2-[(4-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-isopropyl-2-[(4-propoxybenzoyl)thiocarbamoylamino]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3S/c1-4-13-27-16-11-9-15(10-12-16)19(25)24-21(28)23-18-8-6-5-7-17(18)20(26)22-14(2)3/h5-12,14H,4,13H2,1-3H3,(H,22,26)(H2,23,24,25,28)