4-azanyl-2-(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonyl-isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonyl-isoindole-1,3-dione Openeye Name: 4-amino-2-(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)isoindoline-1,3-dione CAS Name: 4-amino-2-[(3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-(3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carbonyl)isoindole-1,3-dione Traditional Name: 4-amino-2-(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)isoindoline-1,3-quinone Formula: C21H14N4O3S MolecularWeight: 402.42586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)C5=CC=CC=C5

InChI

InChI=1S/C21H14N4O3S/c1-11-14-10-16(29-21(14)25(23-11)12-6-3-2-4-7-12)19(27)24-18(26)13-8-5-9-15(22)17(13)20(24)28/h2-10H,22H2,1H3