[2-(4-hydroxyphenyl)-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]carbonyl-1-benzothiophen-6-yl]oxyiodanuidyl-phenyl-methanone

Systemtic Name: [2-(4-hydroxyphenyl)-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]carbonyl-1-benzothiophen-6-yl]oxyiodanuidyl-phenyl-methanone Openeye Name: [2-(4-hydroxyphenyl)-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)benzoyl]benzothiophen-6-yl]oxyiodanuidyl-phenyl-methanone CAS Name: [2-(4-hydroxyphenyl)-3-[[3-methyl-4-(1-pyrrolidinylmethyl)phenyl]-oxomethyl]-1-benzothiophen-6-yl]oxyiodanuidyl-phenylmethanone IUPAC Name: [2-(4-hydroxyphenyl)-3-[3-methyl-4-(pyrrolidin-1-ylmethyl)benzoyl]-1-benzothiophen-6-yl]oxyiodanuidyl-phenylmethanone Traditional Name: [2-(4-hydroxyphenyl)-3-[3-methyl-4-(pyrrolidinomethyl)benzoyl]benzothiophen-6-yl]oxyiodanuidyl-phenyl-methanone Formula: C34H29INO4S- MolecularWeight: 674.56783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2=C(SC3=C2C=CC(=C3)O[I-]C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)O)CN6CCCC6

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C2=C(SC3=C2C=CC(=C3)O[I-]C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)O)CN6CCCC6

InChI

InChI=1S/C34H29INO4S/c1-22-19-25(9-10-26(22)21-36-17-5-6-18-36)32(38)31-29-16-15-28(40-35-34(39)24-7-3-2-4-8-24)20-30(29)41-33(31)23-11-13-27(37)14-12-23/h2-4,7-16,19-20,37H,5-6,17-18,21H2,1H3/q-1