1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NC3CCCCC3C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)N[C@H]3CCCC[C@@H]3C

InChI

InChI=1S/C19H25N5O2S/c1-3-24-18(26)14-10-6-5-9-13(14)16(23-24)17(25)21-22-19(27)20-15-11-7-4-8-12(15)2/h5-6,9-10,12,15H,3-4,7-8,11H2,1-2H3,(H,21,25)(H2,20,22,27)/t12-,15-/m0/s1