(E)-N-[5-(3-chloranyl-5-methyl-phenyl)thiophen-2-yl]-4-pyrrolidin-3-yl-but-2-enamide

Systemtic Name: (E)-N-[5-(3-chloranyl-5-methyl-phenyl)thiophen-2-yl]-4-pyrrolidin-3-yl-but-2-enamide Openeye Name: (E)-N-[5-(3-chloro-5-methyl-phenyl)-2-thienyl]-4-pyrrolidin-3-yl-but-2-enamide CAS Name: (E)-N-[5-(3-chloro-5-methylphenyl)-2-thiophenyl]-4-(3-pyrrolidinyl)-2-butenamide IUPAC Name: (E)-N-[5-(3-chloro-5-methylphenyl)thiophen-2-yl]-4-pyrrolidin-3-ylbut-2-enamide Traditional Name: (E)-N-[5-(3-chloro-5-methyl-phenyl)-2-thienyl]-4-pyrrolidin-3-yl-but-2-enamide Formula: C19H21ClN2OS MolecularWeight: 360.90084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CC=C(S2)NC(=O)C=CCC3CCNC3)Cl

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CC=C(S2)NC(=O)/C=C/CC3CCNC3)Cl

InChI

InChI=1S/C19H21ClN2OS/c1-13-9-15(11-16(20)10-13)17-5-6-19(24-17)22-18(23)4-2-3-14-7-8-21-12-14/h2,4-6,9-11,14,21H,3,7-8,12H2,1H3,(H,22,23)/b4-2+