3,3-diethyl-N-[(4-iodophenyl)methyl]-2-[4-(4-methylpiperazin-1-yl)carbonylphenoxy]-4-oxidanylidene-azetidine-1-carboxamide

Systemtic Name: 3,3-diethyl-N-[(4-iodophenyl)methyl]-2-[4-(4-methylpiperazin-1-yl)carbonylphenoxy]-4-oxidanylidene-azetidine-1-carboxamide Openeye Name: 3,3-diethyl-N-[(4-iodophenyl)methyl]-2-[4-(4-methylpiperazine-1-carbonyl)phenoxy]-4-oxo-azetidine-1-carboxamide CAS Name: 3,3-diethyl-N-[(4-iodophenyl)methyl]-2-[4-[(4-methyl-1-piperazinyl)-oxomethyl]phenoxy]-4-oxo-1-azetidinecarboxamide IUPAC Name: 3,3-diethyl-N-[(4-iodophenyl)methyl]-2-[4-(4-methylpiperazine-1-carbonyl)phenoxy]-4-oxoazetidine-1-carboxamide Traditional Name: 3,3-diethyl-N-(4-iodobenzyl)-2-keto-4-[4-(4-methylpiperazine-1-carbonyl)phenoxy]azetidine-1-carboxamide Formula: C27H33IN4O4 MolecularWeight: 604.47979

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(=O)NCC2=CC=C(C=C2)I)OC3=CC=C(C=C3)C(=O)N4CCN(CC4)C)CC

Isomeric SMILES

CCC1(C(N(C1=O)C(=O)NCC2=CC=C(C=C2)I)OC3=CC=C(C=C3)C(=O)N4CCN(CC4)C)CC

InChI

InChI=1S/C27H33IN4O4/c1-4-27(5-2)24(34)32(26(35)29-18-19-6-10-21(28)11-7-19)25(27)36-22-12-8-20(9-13-22)23(33)31-16-14-30(3)15-17-31/h6-13,25H,4-5,14-18H2,1-3H3,(H,29,35)