(E)-3-[1-[(3-methylphenyl)methyl]indol-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[1-[(3-methylphenyl)methyl]indol-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (E)-2-(benzenesulfonyl)-3-[1-(m-tolylmethyl)indol-3-yl]prop-2-enenitrile CAS Name: (E)-2-(benzenesulfonyl)-3-[1-[(3-methylphenyl)methyl]-3-indolyl]-2-propenenitrile IUPAC Name: (E)-2-(benzenesulfonyl)-3-[1-[(3-methylphenyl)methyl]indol-3-yl]prop-2-enenitrile Traditional Name: (E)-2-besyl-3-[1-(3-methylbenzyl)indol-3-yl]acrylonitrile Formula: C25H20N2O2S MolecularWeight: 412.5035

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)C=C(C#N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)/C=C(\C#N)/S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H20N2O2S/c1-19-8-7-9-20(14-19)17-27-18-21(24-12-5-6-13-25(24)27)15-23(16-26)30(28,29)22-10-3-2-4-11-22/h2-15,18H,17H2,1H3/b23-15+