methyl 2-[[(E)-2-cyano-3-(1-propan-2-ylindol-3-yl)prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-(1-propan-2-ylindol-3-yl)prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-(1-isopropylindol-3-yl)prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-(1-propan-2-yl-3-indolyl)prop-2-enyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-(1-propan-2-ylindol-3-yl)prop-2-enoyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(1-isopropylindol-3-yl)acryloyl]amino]-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C27H23N3O3S MolecularWeight: 469.55482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=CC=CC=C21)C=C(C#N)C(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(C)N1C=C(C2=CC=CC=C21)/C=C(\C#N)/C(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C27H23N3O3S/c1-17(2)30-16-20(21-11-7-8-12-23(21)30)13-19(15-28)25(31)29-26-22(27(32)33-3)14-24(34-26)18-9-5-4-6-10-18/h4-14,16-17H,1-3H3,(H,29,31)/b19-13+