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

Systemtic Name: 1-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)thiourea CAS Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-prop-2-enylthiourea IUPAC Name: 1-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(1,4-diketo-2,3-dihydrophthalazin-5-yl)thiourea Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=CC=CC2=C1C(=O)NNC2=O

Isomeric SMILES

C=CCNC(=S)NC1=CC=CC2=C1C(=O)NNC2=O

InChI

InChI=1S/C12H12N4O2S/c1-2-6-13-12(19)14-8-5-3-4-7-9(8)11(18)16-15-10(7)17/h2-5H,1,6H2,(H,15,17)(H,16,18)(H2,13,14,19)