N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-2-phenothiazin-10-yl-ethanamide

Systemtic Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-2-phenothiazin-10-yl-ethanamide Openeye Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-2-phenothiazin-10-yl-acetamide CAS Name: N-[(E)-(1,3-diphenyl-4-pyrazolyl)methylideneamino]-2-(10-phenothiazinyl)acetamide IUPAC Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-2-phenothiazin-10-ylacetamide Traditional Name: N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-2-phenothiazin-10-yl-acetamide Formula: C30H23N5OS MolecularWeight: 501.60152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)CN3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/NC(=O)CN3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

InChI

InChI=1S/C30H23N5OS/c36-29(21-34-25-15-7-9-17-27(25)37-28-18-10-8-16-26(28)34)32-31-19-23-20-35(24-13-5-2-6-14-24)33-30(23)22-11-3-1-4-12-22/h1-20H,21H2,(H,32,36)/b31-19+