(E)-3-(3-chloranyl-1-benzothiophen-2-yl)-N-(4-piperidin-1-ylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-1-benzothiophen-2-yl)-N-(4-piperidin-1-ylphenyl)prop-2-enamide Openeye Name: (E)-3-(3-chlorobenzothiophen-2-yl)-N-[4-(1-piperidyl)phenyl]prop-2-enamide CAS Name: (E)-3-(3-chloro-1-benzothiophen-2-yl)-N-[4-(1-piperidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-chloro-1-benzothiophen-2-yl)-N-(4-piperidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(3-chlorobenzothiophen-2-yl)-N-(4-piperidinophenyl)acrylamide Formula: C22H21ClN2OS MolecularWeight: 396.93294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C=CC3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)/C=C/C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H21ClN2OS/c23-22-18-6-2-3-7-19(18)27-20(22)12-13-21(26)24-16-8-10-17(11-9-16)25-14-4-1-5-15-25/h2-3,6-13H,1,4-5,14-15H2,(H,24,26)/b13-12+