[2-iodanyl-4-(8-morpholin-4-yloctan-2-ylsulfanylmethyl)-3-propan-2-yl-phenyl]-(4-methoxyphenyl)methanone

Systemtic Name: [2-iodanyl-4-(8-morpholin-4-yloctan-2-ylsulfanylmethyl)-3-propan-2-yl-phenyl]-(4-methoxyphenyl)methanone Openeye Name: [2-iodo-3-isopropyl-4-[(1-methyl-7-morpholino-heptyl)sulfanylmethyl]phenyl]-(4-methoxyphenyl)methanone CAS Name: [2-iodo-4-[[8-(4-morpholinyl)octan-2-ylthio]methyl]-3-propan-2-ylphenyl]-(4-methoxyphenyl)methanone IUPAC Name: [2-iodo-4-(8-morpholin-4-yloctan-2-ylsulfanylmethyl)-3-propan-2-ylphenyl]-(4-methoxyphenyl)methanone Traditional Name: [2-iodo-3-isopropyl-4-[[(1-methyl-7-morpholino-heptyl)thio]methyl]phenyl]-(4-methoxyphenyl)methanone Formula: C30H42INO3S MolecularWeight: 623.62885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1I)C(=O)C2=CC=C(C=C2)OC)CSC(C)CCCCCCN3CCOCC3

Isomeric SMILES

CC(C)C1=C(C=CC(=C1I)C(=O)C2=CC=C(C=C2)OC)CSC(C)CCCCCCN3CCOCC3

InChI

InChI=1S/C30H42INO3S/c1-22(2)28-25(12-15-27(29(28)31)30(33)24-10-13-26(34-4)14-11-24)21-36-23(3)9-7-5-6-8-16-32-17-19-35-20-18-32/h10-15,22-23H,5-9,16-21H2,1-4H3