N-[1-[4-[(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]pyrazol-4-yl]ethanamide

Systemtic Name: N-[1-[4-[(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]pyrazol-4-yl]ethanamide Openeye Name: N-[1-[4-(5-chloro-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]pyrazol-4-yl]acetamide CAS Name: N-[1-[4-[(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]phenyl]-4-pyrazolyl]acetamide IUPAC Name: N-[1-[4-(5-chloro-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]pyrazol-4-yl]acetamide Traditional Name: N-[1-[4-(5-chloro-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]pyrazol-4-yl]acetamide Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN(N=C1)C2=CC=C(C=C2)C(=O)N3CCC4=C(C3)C=CC=C4Cl

Isomeric SMILES

CC(=O)NC1=CN(N=C1)C2=CC=C(C=C2)C(=O)N3CCC4=C(C3)C=CC=C4Cl

InChI

InChI=1S/C21H19ClN4O2/c1-14(27)24-17-11-23-26(13-17)18-7-5-15(6-8-18)21(28)25-10-9-19-16(12-25)3-2-4-20(19)22/h2-8,11,13H,9-10,12H2,1H3,(H,24,27)