1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(2-methylprop-2-enyl)thiourea

Systemtic Name: 1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(2-methylprop-2-enyl)thiourea Openeye Name: 1-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]-3-(2-methylallyl)thiourea CAS Name: 1-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-3-(2-methylprop-2-enyl)thiourea IUPAC Name: 1-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]-3-(2-methylprop-2-enyl)thiourea Traditional Name: 1-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]-3-(2-methylallyl)thiourea Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N5O2S/c1-4-21-15(23)12-8-6-5-7-11(12)13(20-21)14(22)18-19-16(24)17-9-10(2)3/h5-8H,2,4,9H2,1,3H3,(H,18,22)(H2,17,19,24)