N-[(5-chloranylthiophen-2-yl)methyl]-2-propan-2-yl-N-prop-2-enyl-quinoline-4-carboxamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-2-propan-2-yl-N-prop-2-enyl-quinoline-4-carboxamide Openeye Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-2-isopropyl-quinoline-4-carboxamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-2-propan-2-yl-N-prop-2-enyl-4-quinolinecarboxamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-2-propan-2-yl-N-prop-2-enylquinoline-4-carboxamide Traditional Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-2-isopropyl-cinchoninamide Formula: C21H21ClN2OS MolecularWeight: 384.92224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N(CC=C)CC3=CC=C(S3)Cl

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N(CC=C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C21H21ClN2OS/c1-4-11-24(13-15-9-10-20(22)26-15)21(25)17-12-19(14(2)3)23-18-8-6-5-7-16(17)18/h4-10,12,14H,1,11,13H2,2-3H3