2-[(4-propoxyphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCCC

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCCC

InChI

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