2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1-phenylpyrrol-2-yl)prop-2-enamide

Systemtic Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1-phenylpyrrol-2-yl)prop-2-enamide Openeye Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(1-phenylpyrrol-2-yl)prop-2-enamide CAS Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1-phenyl-2-pyrrolyl)-2-propenamide IUPAC Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1-phenylpyrrol-2-yl)prop-2-enamide Traditional Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(1-phenylpyrrol-2-yl)acrylamide Formula: C23H18N4OS MolecularWeight: 398.48022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=CC3=CC=CN3C4=CC=CC=C4)C#N)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=CC3=CC=CN3C4=CC=CC=C4)C#N)C#N

InChI

InChI=1S/C23H18N4OS/c24-14-16(13-18-9-6-12-27(18)17-7-2-1-3-8-17)22(28)26-23-20(15-25)19-10-4-5-11-21(19)29-23/h1-3,6-9,12-13H,4-5,10-11H2,(H,26,28)