methyl (6R)-2-[(3-iodanyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl (6R)-2-[(3-iodanyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl (6R)-2-[(3-iodo-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6R)-2-[(3-iodo-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl (6R)-2-[(3-iodo-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6R)-2-[(3-iodo-6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C19H20INO3S MolecularWeight: 469.33647

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC=C3C=C(C=C(C3=O)C)I

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC(=C2C(=O)OC)NC=C3C=C(C=C(C3=O)C)I

InChI

InChI=1S/C19H20INO3S/c1-10-4-5-14-15(6-10)25-18(16(14)19(23)24-3)21-9-12-8-13(20)7-11(2)17(12)22/h7-10,21H,4-6H2,1-3H3/t10-/m1/s1