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

Systemtic Name: 1-phenyl-3-[1-[2,4,6-tris(oxidanylidene)-1-prop-2-enyl-1,3-diazinan-5-ylidene]propylamino]thiourea Openeye Name: 1-[1-(1-allyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)propylamino]-3-phenyl-thiourea CAS Name: 1-phenyl-3-[1-(2,4,6-trioxo-1-prop-2-enyl-1,3-diazinan-5-ylidene)propylamino]thiourea IUPAC Name: 1-phenyl-3-[1-(2,4,6-trioxo-1-prop-2-enyl-1,3-diazinan-5-ylidene)propylamino]thiourea Traditional Name: 1-[1-(1-allyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)propylamino]-3-phenyl-thiourea Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)NC(=O)N(C1=O)CC=C)NNC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCC(=C1C(=O)NC(=O)N(C1=O)CC=C)NNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C17H19N5O3S/c1-3-10-22-15(24)13(14(23)19-17(22)25)12(4-2)20-21-16(26)18-11-8-6-5-7-9-11/h3,5-9,20H,1,4,10H2,2H3,(H2,18,21,26)(H,19,23,25)