(4-methylpiperazin-1-yl)-[1-prop-2-enyl-5-(2-thiophen-2-ylethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: (4-methylpiperazin-1-yl)-[1-prop-2-enyl-5-(2-thiophen-2-ylethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: [1-allyl-5-[2-(2-thienyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: (4-methyl-1-piperazinyl)-[1-prop-2-enyl-5-(2-thiophen-2-ylethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[1-prop-2-enyl-5-(2-thiophen-2-ylethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: [1-allyl-5-[2-(2-thienyl)ethylamino]-4,5,6,7-tetrahydroindazol-3-yl]-(4-methylpiperazino)methanone Formula: C22H31N5OS MolecularWeight: 413.57944

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=NN(C3=C2CC(CC3)NCCC4=CC=CS4)CC=C

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=NN(C3=C2CC(CC3)NCCC4=CC=CS4)CC=C

InChI

InChI=1S/C22H31N5OS/c1-3-10-27-20-7-6-17(23-9-8-18-5-4-15-29-18)16-19(20)21(24-27)22(28)26-13-11-25(2)12-14-26/h3-5,15,17,23H,1,6-14,16H2,2H3