1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]-3-p-cumenyl-thiourea Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H23N5O2S/c1-4-26-20(28)17-8-6-5-7-16(17)18(25-26)19(27)23-24-21(29)22-15-11-9-14(10-12-15)13(2)3/h5-13H,4H2,1-3H3,(H,23,27)(H2,22,24,29)