1-[(E)-1-[4,6-bis(oxidanylidene)-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-yl]ethylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-1-[4,6-bis(oxidanylidene)-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-yl]ethylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-1-(1-allyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)ethylideneamino]thiourea CAS Name: 1-[(E)-1-(4,6-dioxo-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-yl)ethylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-1-(4,6-dioxo-1-prop-2-enyl-2-sulfanylidene-1,3-diazinan-5-yl)ethylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-1-(1-allyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl)ethylideneamino]thiourea Formula: C13H17N5O2S2 MolecularWeight: 339.43638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC=C)C1C(=O)NC(=S)N(C1=O)CC=C

Isomeric SMILES

C/C(=N\NC(=S)NCC=C)/C1C(=O)NC(=S)N(C1=O)CC=C

InChI

InChI=1S/C13H17N5O2S2/c1-4-6-14-12(21)17-16-8(3)9-10(19)15-13(22)18(7-5-2)11(9)20/h4-5,9H,1-2,6-7H2,3H3,(H2,14,17,21)(H,15,19,22)/b16-8+