3-[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]-2-cyano-prop-2-enethioamide

Systemtic Name: 3-[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]-2-cyano-prop-2-enethioamide Openeye Name: 3-[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]-2-cyano-prop-2-enethioamide CAS Name: 3-[1-[(2-chlorophenyl)methyl]-2-methyl-3-indolyl]-2-cyano-2-propenethioamide IUPAC Name: 3-[1-[(2-chlorophenyl)methyl]-2-methylindol-3-yl]-2-cyanoprop-2-enethioamide Traditional Name: 3-[1-(2-chlorobenzyl)-2-methyl-indol-3-yl]-2-cyano-thioacrylamide Formula: C20H16ClN3S MolecularWeight: 365.87914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3Cl)C=C(C#N)C(=S)N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3Cl)C=C(C#N)C(=S)N

InChI

InChI=1S/C20H16ClN3S/c1-13-17(10-15(11-22)20(23)25)16-7-3-5-9-19(16)24(13)12-14-6-2-4-8-18(14)21/h2-10H,12H2,1H3,(H2,23,25)