1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]-3-(tetrahydrofurfuryl)thiourea Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3CCCO3

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3CCCO3

InChI

InChI=1S/C17H21N5O3S/c1-2-22-16(24)13-8-4-3-7-12(13)14(21-22)15(23)19-20-17(26)18-10-11-6-5-9-25-11/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,19,23)(H2,18,20,26)