3-[(4-butoxyphenyl)carbonylcarbamothioylamino]-N,N-dipropyl-benzamide

Systemtic Name: 3-[(4-butoxyphenyl)carbonylcarbamothioylamino]-N,N-dipropyl-benzamide Openeye Name: 3-[(4-butoxybenzoyl)carbamothioylamino]-N,N-dipropyl-benzamide CAS Name: 3-[[[[(4-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N,N-dipropylbenzamide IUPAC Name: 3-[(4-butoxybenzoyl)carbamothioylamino]-N,N-dipropylbenzamide Traditional Name: 3-[(4-butoxybenzoyl)thiocarbamoylamino]-N,N-dipropyl-benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CCC)CCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CCC)CCC

InChI

InChI=1S/C25H33N3O3S/c1-4-7-17-31-22-13-11-19(12-14-22)23(29)27-25(32)26-21-10-8-9-20(18-21)24(30)28(15-5-2)16-6-3/h8-14,18H,4-7,15-17H2,1-3H3,(H2,26,27,29,32)