1-(2-methoxyethyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(2-methoxyethyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(2-methoxyethyl)-3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-[(4-keto-3H-phthalazine-1-carbonyl)amino]-3-(2-methoxyethyl)thiourea Formula: C13H15N5O3S MolecularWeight: 321.3549

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NNC(=O)C1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

COCCNC(=S)NNC(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C13H15N5O3S/c1-21-7-6-14-13(22)18-17-12(20)10-8-4-2-3-5-9(8)11(19)16-15-10/h2-5H,6-7H2,1H3,(H,16,19)(H,17,20)(H2,14,18,22)