1-(furan-2-ylmethyl)-3-[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(2-furylmethyl)-3-[(3-isopropyl-4-oxo-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(2-furanylmethyl)-3-[[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]amino]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-[(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(2-furfuryl)-3-[(3-isopropyl-4-keto-phthalazine-1-carbonyl)amino]thiourea Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3=CC=CO3

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3=CC=CO3

InChI

InChI=1S/C18H19N5O3S/c1-11(2)23-17(25)14-8-4-3-7-13(14)15(22-23)16(24)20-21-18(27)19-10-12-6-5-9-26-12/h3-9,11H,10H2,1-2H3,(H,20,24)(H2,19,21,27)