3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carbonitrile

Systemtic Name: 3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carbonitrile Openeye Name: 3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carbonitrile CAS Name: 3-[(4-methoxyphenyl)thio]-6-methylsulfonyl-1H-indole-2-carbonitrile IUPAC Name: 3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carbonitrile Traditional Name: 6-mesyl-3-[(4-methoxyphenyl)thio]-1H-indole-2-carbonitrile Formula: C17H14N2O3S2 MolecularWeight: 358.43466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=C(NC3=C2C=CC(=C3)S(=O)(=O)C)C#N

Isomeric SMILES

COC1=CC=C(C=C1)SC2=C(NC3=C2C=CC(=C3)S(=O)(=O)C)C#N

InChI

InChI=1S/C17H14N2O3S2/c1-22-11-3-5-12(6-4-11)23-17-14-8-7-13(24(2,20)21)9-15(14)19-16(17)10-18/h3-9,19H,1-2H3