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

Systemtic Name: N-propan-2-yl-3-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-isopropyl-3-[(4-propoxybenzoyl)carbamothioylamino]benzamide CAS Name: 3-[[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: N-propan-2-yl-3-[(4-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-isopropyl-3-[(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(=C2)C(=O)NC(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)C

InChI

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