N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-1-(2-chlorophenyl)-2-oxidanyl-3-oxidanylidene-propyl]-N,4-diethyl-benzamide

Systemtic Name: N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-1-(2-chlorophenyl)-2-oxidanyl-3-oxidanylidene-propyl]-N,4-diethyl-benzamide Openeye Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-1-(2-chlorophenyl)-2-hydroxy-3-oxo-propyl]-N,4-diethyl-benzamide CAS Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-1-(2-chlorophenyl)-2-hydroxy-3-oxopropyl]-N,4-diethylbenzamide IUPAC Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-1-(2-chlorophenyl)-2-hydroxy-3-oxopropyl]-N,4-diethylbenzamide Traditional Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-1-(2-chlorophenyl)-2-hydroxy-3-keto-propyl]-N,4-diethyl-benzamide Formula: C27H28ClN5O3 MolecularWeight: 505.99592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CC)C(C2=CC=CC=C2Cl)C(C(=O)NC3=CC4=C(C=C3)N=C(N4)N)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CC)C(C2=CC=CC=C2Cl)C(C(=O)NC3=CC4=C(C=C3)N=C(N4)N)O

InChI

InChI=1S/C27H28ClN5O3/c1-3-16-9-11-17(12-10-16)26(36)33(4-2)23(19-7-5-6-8-20(19)28)24(34)25(35)30-18-13-14-21-22(15-18)32-27(29)31-21/h5-15,23-24,34H,3-4H2,1-2H3,(H,30,35)(H3,29,31,32)