1-(2-methylpropyl)-3-[4-(phenylmethyl)-6-[(3S)-3-propan-2-ylpiperazin-1-yl]carbonyl-pyridazin-3-yl]urea

Systemtic Name: 1-(2-methylpropyl)-3-[4-(phenylmethyl)-6-[(3S)-3-propan-2-ylpiperazin-1-yl]carbonyl-pyridazin-3-yl]urea Openeye Name: 1-[4-benzyl-6-[(3S)-3-isopropylpiperazine-1-carbonyl]pyridazin-3-yl]-3-isobutyl-urea CAS Name: 1-(2-methylpropyl)-3-[6-[oxo-[(3S)-3-propan-2-yl-1-piperazinyl]methyl]-4-(phenylmethyl)-3-pyridazinyl]urea IUPAC Name: 1-[4-benzyl-6-[(3S)-3-propan-2-ylpiperazine-1-carbonyl]pyridazin-3-yl]-3-(2-methylpropyl)urea Traditional Name: 1-[4-benzyl-6-[(3S)-3-isopropylpiperazine-1-carbonyl]pyridazin-3-yl]-3-isobutyl-urea Formula: C24H34N6O2 MolecularWeight: 438.56576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC1=NN=C(C=C1CC2=CC=CC=C2)C(=O)N3CCNC(C3)C(C)C

Isomeric SMILES

CC(C)CNC(=O)NC1=NN=C(C=C1CC2=CC=CC=C2)C(=O)N3CCN[C@H](C3)C(C)C

InChI

InChI=1S/C24H34N6O2/c1-16(2)14-26-24(32)27-22-19(12-18-8-6-5-7-9-18)13-20(28-29-22)23(31)30-11-10-25-21(15-30)17(3)4/h5-9,13,16-17,21,25H,10-12,14-15H2,1-4H3,(H2,26,27,29,32)/t21-/m1/s1