10-butyl-3-(5-cyclopentyl-1-methyl-pyrazol-3-yl)phenothiazine

Systemtic Name: 10-butyl-3-(5-cyclopentyl-1-methyl-pyrazol-3-yl)phenothiazine Openeye Name: 10-butyl-3-(5-cyclopentyl-1-methyl-pyrazol-3-yl)phenothiazine CAS Name: 10-butyl-3-(5-cyclopentyl-1-methyl-3-pyrazolyl)phenothiazine IUPAC Name: 10-butyl-3-(5-cyclopentyl-1-methylpyrazol-3-yl)phenothiazine Traditional Name: 10-butyl-3-(5-cyclopentyl-1-methyl-pyrazol-3-yl)phenothiazine Formula: C25H24N3S MolecularWeight: 398.54316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C3=NN(C(=C3)[C]4[CH][CH][CH][CH]4)C)SC5=CC=CC=C51

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C3=NN(C(=C3)[C]4[CH][CH][CH][CH]4)C)SC5=CC=CC=C51

InChI

InChI=1S/C25H24N3S/c1-3-4-15-28-21-11-7-8-12-24(21)29-25-16-19(13-14-22(25)28)20-17-23(27(2)26-20)18-9-5-6-10-18/h5-14,16-17H,3-4,15H2,1-2H3