2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-N-(butylcarbamoyl)propanamide

Systemtic Name: 2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-N-(butylcarbamoyl)propanamide Openeye Name: 2-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-amino]-N-(butylcarbamoyl)propanamide CAS Name: 2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-N-[butylamino(oxo)methyl]propanamide IUPAC Name: 2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-N-(butylcarbamoyl)propanamide Traditional Name: 2-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-amino]-N-(butylcarbamoyl)propionamide Formula: C18H27BrN4O3 MolecularWeight: 427.33598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C(C)N(C)CC(=O)NC1=C(C=C(C=C1)Br)C

Isomeric SMILES

CCCCNC(=O)NC(=O)C(C)N(C)CC(=O)NC1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C18H27BrN4O3/c1-5-6-9-20-18(26)22-17(25)13(3)23(4)11-16(24)21-15-8-7-14(19)10-12(15)2/h7-8,10,13H,5-6,9,11H2,1-4H3,(H,21,24)(H2,20,22,25,26)