4-[(4-butoxyphenyl)carbonylcarbamothioylamino]-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 4-[(4-butoxyphenyl)carbonylcarbamothioylamino]-N-(furan-2-ylmethyl)benzamide Openeye Name: 4-[(4-butoxybenzoyl)carbamothioylamino]-N-(2-furylmethyl)benzamide CAS Name: 4-[[[[(4-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(2-furanylmethyl)benzamide IUPAC Name: 4-[(4-butoxybenzoyl)carbamothioylamino]-N-(furan-2-ylmethyl)benzamide Traditional Name: 4-[(4-butoxybenzoyl)thiocarbamoylamino]-N-(2-furfuryl)benzamide Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C24H25N3O4S/c1-2-3-14-30-20-12-8-18(9-13-20)23(29)27-24(32)26-19-10-6-17(7-11-19)22(28)25-16-21-5-4-15-31-21/h4-13,15H,2-3,14,16H2,1H3,(H,25,28)(H2,26,27,29,32)