4-[(Z)-[3-(diethylaminomethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(Z)-[3-(diethylaminomethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(Z)-[3-(diethylaminomethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-(2-thienyl)-1,2-dihydropyrazol-3-one CAS Name: 4-[(Z)-[3-(diethylaminomethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(Z)-[3-(diethylaminomethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(Z)-[3-(diethylaminomethyl)-4,5,6,7-tetrahydroindol-2-ylidene]methyl]-5-(2-thienyl)-3-pyrazolin-3-one Formula: C21H26N4OS MolecularWeight: 382.52234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C2CCCCC2=NC1=CC3=C(NNC3=O)C4=CC=CS4

Isomeric SMILES

CCN(CC)CC\1=C2CCCCC2=N/C1=C\C3=C(NNC3=O)C4=CC=CS4

InChI

InChI=1S/C21H26N4OS/c1-3-25(4-2)13-16-14-8-5-6-9-17(14)22-18(16)12-15-20(23-24-21(15)26)19-10-7-11-27-19/h7,10-12H,3-6,8-9,13H2,1-2H3,(H2,23,24,26)/b18-12-