2-[2-[(8-chloranyl-11H-indolo[3,2-c]isoquinolin-5-yl)sulfanyl]ethanoyl]-5-methyl-4H-pyrazol-3-one

Systemtic Name: 2-[2-[(8-chloranyl-11H-indolo[3,2-c]isoquinolin-5-yl)sulfanyl]ethanoyl]-5-methyl-4H-pyrazol-3-one Openeye Name: 2-[2-[(8-chloro-11H-indolo[3,2-c]isoquinolin-5-yl)sulfanyl]acetyl]-5-methyl-4H-pyrazol-3-one CAS Name: 2-[2-[(8-chloro-11H-indolo[3,2-c]isoquinolin-5-yl)thio]-1-oxoethyl]-5-methyl-4H-pyrazol-3-one IUPAC Name: 2-[2-[(8-chloro-11H-indolo[3,2-c]isoquinolin-5-yl)sulfanyl]acetyl]-5-methyl-4H-pyrazol-3-one Traditional Name: 2-[2-[(8-chloro-11H-indol[3,2-c]isoquinolin-5-yl)thio]acetyl]-5-methyl-2-pyrazolin-3-one Formula: C21H15ClN4O2S MolecularWeight: 422.8874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C(=O)CSC2=NC3=C(C4=CC=CC=C42)NC5=C3C=C(C=C5)Cl

Isomeric SMILES

CC1=NN(C(=O)C1)C(=O)CSC2=NC3=C(C4=CC=CC=C42)NC5=C3C=C(C=C5)Cl

InChI

InChI=1S/C21H15ClN4O2S/c1-11-8-17(27)26(25-11)18(28)10-29-21-14-5-3-2-4-13(14)19-20(24-21)15-9-12(22)6-7-16(15)23-19/h2-7,9,23H,8,10H2,1H3