1-phenyl-3-[1-[2,4,6-tris(oxidanylidene)-1-phenyl-1,3-diazinan-5-ylidene]propylamino]thiourea

Systemtic Name: 1-phenyl-3-[1-[2,4,6-tris(oxidanylidene)-1-phenyl-1,3-diazinan-5-ylidene]propylamino]thiourea Openeye Name: 1-phenyl-3-[1-(2,4,6-trioxo-1-phenyl-hexahydropyrimidin-5-ylidene)propylamino]thiourea CAS Name: 1-phenyl-3-[1-(2,4,6-trioxo-1-phenyl-1,3-diazinan-5-ylidene)propylamino]thiourea IUPAC Name: 1-phenyl-3-[1-(2,4,6-trioxo-1-phenyl-1,3-diazinan-5-ylidene)propylamino]thiourea Traditional Name: 1-phenyl-3-[1-(2,4,6-triketo-1-phenyl-hexahydropyrimidin-5-ylidene)propylamino]thiourea Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2)NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2)NNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C20H19N5O3S/c1-2-15(23-24-19(29)21-13-9-5-3-6-10-13)16-17(26)22-20(28)25(18(16)27)14-11-7-4-8-12-14/h3-12,23H,2H2,1H3,(H2,21,24,29)(H,22,26,28)