N-butyl-3-[3-(methylamino)-3-oxidanylidene-propyl]-5-phenyl-2-[1-(phenylcarbamoylamino)ethyl]imidazole-4-carboxamide

Systemtic Name: N-butyl-3-[3-(methylamino)-3-oxidanylidene-propyl]-5-phenyl-2-[1-(phenylcarbamoylamino)ethyl]imidazole-4-carboxamide Openeye Name: N-butyl-3-[3-(methylamino)-3-oxo-propyl]-5-phenyl-2-[1-(phenylcarbamoylamino)ethyl]imidazole-4-carboxamide CAS Name: 2-[1-[[anilino(oxo)methyl]amino]ethyl]-N-butyl-3-[3-(methylamino)-3-oxopropyl]-5-phenyl-4-imidazolecarboxamide IUPAC Name: N-butyl-3-[3-(methylamino)-3-oxopropyl]-5-phenyl-2-[1-(phenylcarbamoylamino)ethyl]imidazole-4-carboxamide Traditional Name: N-butyl-3-[3-keto-3-(methylamino)propyl]-5-phenyl-2-[1-(phenylcarbamoylamino)ethyl]imidazole-4-carboxamide Formula: C27H34N6O3 MolecularWeight: 490.59726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N=C(N1CCC(=O)NC)C(C)NC(=O)NC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=C(N=C(N1CCC(=O)NC)C(C)NC(=O)NC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H34N6O3/c1-4-5-17-29-26(35)24-23(20-12-8-6-9-13-20)32-25(33(24)18-16-22(34)28-3)19(2)30-27(36)31-21-14-10-7-11-15-21/h6-15,19H,4-5,16-18H2,1-3H3,(H,28,34)(H,29,35)(H2,30,31,36)