2-[butyl(furan-2-ylmethyl)amino]-5-(2-phenylsulfanylethanoylamino)-N-propyl-benzamide

Systemtic Name: 2-[butyl(furan-2-ylmethyl)amino]-5-(2-phenylsulfanylethanoylamino)-N-propyl-benzamide Openeye Name: 2-[butyl(2-furylmethyl)amino]-5-[(2-phenylsulfanylacetyl)amino]-N-propyl-benzamide CAS Name: 2-[butyl(2-furanylmethyl)amino]-5-[[1-oxo-2-(phenylthio)ethyl]amino]-N-propylbenzamide IUPAC Name: 2-[butyl(furan-2-ylmethyl)amino]-5-[(2-phenylsulfanylacetyl)amino]-N-propylbenzamide Traditional Name: 2-[butyl(2-furfuryl)amino]-5-[[2-(phenylthio)acetyl]amino]-N-propyl-benzamide Formula: C27H33N3O3S MolecularWeight: 479.63422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=CC=C3)C(=O)NCCC

Isomeric SMILES

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=CC=C3)C(=O)NCCC

InChI

InChI=1S/C27H33N3O3S/c1-3-5-16-30(19-22-10-9-17-33-22)25-14-13-21(18-24(25)27(32)28-15-4-2)29-26(31)20-34-23-11-7-6-8-12-23/h6-14,17-18H,3-5,15-16,19-20H2,1-2H3,(H,28,32)(H,29,31)