1-cyclopentyl-3-[[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]thiourea Openeye Name: 1-cyclopentyl-3-[(3-isobutyl-4-oxo-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-cyclopentyl-3-[[[3-(2-methylpropyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[3-(2-methylpropyl)-4-oxophthalazine-1-carbonyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[(3-isobutyl-4-keto-phthalazine-1-carbonyl)amino]thiourea Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NC3CCCC3

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NC3CCCC3

InChI

InChI=1S/C19H25N5O2S/c1-12(2)11-24-18(26)15-10-6-5-9-14(15)16(23-24)17(25)21-22-19(27)20-13-7-3-4-8-13/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,21,25)(H2,20,22,27)