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

Systemtic Name: N-propan-2-yl-3-[(3-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-isopropyl-3-[(3-propoxybenzoyl)carbamothioylamino]benzamide CAS Name: 3-[[[[oxo-(3-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: N-propan-2-yl-3-[(3-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-isopropyl-3-[(3-propoxybenzoyl)thiocarbamoylamino]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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