1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-pyridin-3-yl-thiourea

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-pyridin-3-yl-thiourea Openeye Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(3-pyridyl)thiourea CAS Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(3-pyridinyl)thiourea IUPAC Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-pyridin-3-ylthiourea Traditional Name: 1-(1,4-diketo-2,3-dihydrophthalazin-5-yl)-3-(3-pyridyl)thiourea Formula: C14H11N5O2S MolecularWeight: 313.33444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=S)NC3=CN=CC=C3)C(=O)NNC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=S)NC3=CN=CC=C3)C(=O)NNC2=O

InChI

InChI=1S/C14H11N5O2S/c20-12-9-4-1-5-10(11(9)13(21)19-18-12)17-14(22)16-8-3-2-6-15-7-8/h1-7H,(H,18,20)(H,19,21)(H2,16,17,22)