N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H15BrN4O3S MolecularWeight: 483.3378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NN=CC3=CC4=C(C=C3Br)OCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)N/N=C/C3=CC4=C(C=C3Br)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C21H15BrN4O3S/c1-12-15-8-19(30-21(15)26(25-12)14-5-3-2-4-6-14)20(27)24-23-10-13-7-17-18(9-16(13)22)29-11-28-17/h2-10H,11H2,1H3,(H,24,27)/b23-10+