1-[(3R,3aS,7E)-3-(4-dimethylaminophenyl)-7-[(4-dimethylaminophenyl)methylidene]-5-propyl-3,3a,4,6-tetrahydropyrazolo[4,3-c]pyridin-2-yl]ethanone

Systemtic Name: 1-[(3R,3aS,7E)-3-(4-dimethylaminophenyl)-7-[(4-dimethylaminophenyl)methylidene]-5-propyl-3,3a,4,6-tetrahydropyrazolo[4,3-c]pyridin-2-yl]ethanone Openeye Name: 1-[(3R,3aS,7E)-3-(4-dimethylaminophenyl)-7-[(4-dimethylaminophenyl)methylene]-5-propyl-3,3a,4,6-tetrahydropyrazolo[4,3-c]pyridin-2-yl]ethanone CAS Name: 1-[(3R,3aS,7E)-3-(4-dimethylaminophenyl)-7-[(4-dimethylaminophenyl)methylidene]-5-propyl-3,3a,4,6-tetrahydropyrazolo[4,3-c]pyridin-2-yl]ethanone IUPAC Name: 1-[(3R,3aS,7E)-3-(4-dimethylaminophenyl)-7-[(4-dimethylaminophenyl)methylidene]-5-propyl-3,3a,4,6-tetrahydropyrazolo[4,3-c]pyridin-2-yl]ethanone Traditional Name: 1-[(3R,3aS,7E)-7-[4-(dimethylamino)benzylidene]-3-(4-dimethylaminophenyl)-5-propyl-3,3a,4,6-tetrahydropyrazolo[4,3-c]pyridin-2-yl]ethanone Formula: C28H37N5O MolecularWeight: 459.62628

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2C(N(N=C2C(=CC3=CC=C(C=C3)N(C)C)C1)C(=O)C)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCCN1C[C@H]2[C@@H](N(N=C2/C(=C/C3=CC=C(C=C3)N(C)C)/C1)C(=O)C)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C28H37N5O/c1-7-16-32-18-23(17-21-8-12-24(13-9-21)30(3)4)27-26(19-32)28(33(29-27)20(2)34)22-10-14-25(15-11-22)31(5)6/h8-15,17,26,28H,7,16,18-19H2,1-6H3/b23-17+/t26-,28+/m1/s1