3-[(4-butoxyphenyl)carbonylcarbamothioylamino]-N-butyl-benzamide

Systemtic Name: 3-[(4-butoxyphenyl)carbonylcarbamothioylamino]-N-butyl-benzamide Openeye Name: 3-[(4-butoxybenzoyl)carbamothioylamino]-N-butyl-benzamide CAS Name: 3-[[[[(4-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-butylbenzamide IUPAC Name: 3-[(4-butoxybenzoyl)carbamothioylamino]-N-butylbenzamide Traditional Name: 3-[(4-butoxybenzoyl)thiocarbamoylamino]-N-butyl-benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCCC

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCCC

InChI

InChI=1S/C23H29N3O3S/c1-3-5-14-24-21(27)18-8-7-9-19(16-18)25-23(30)26-22(28)17-10-12-20(13-11-17)29-15-6-4-2/h7-13,16H,3-6,14-15H2,1-2H3,(H,24,27)(H2,25,26,28,30)