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

Systemtic Name: 1-[1-[1-(4-chlorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]ethylamino]-3-phenyl-thiourea Openeye Name: 1-[1-[1-(4-chlorophenyl)-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]ethylamino]-3-phenyl-thiourea CAS Name: 1-[1-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]ethylamino]-3-phenylthiourea IUPAC Name: 1-[1-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]ethylamino]-3-phenylthiourea Traditional Name: 1-[1-[1-(4-chlorophenyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]ethylamino]-3-phenyl-thiourea Formula: C19H16ClN5O3S MolecularWeight: 429.88004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClN5O3S/c1-11(23-24-18(29)21-13-5-3-2-4-6-13)15-16(26)22-19(28)25(17(15)27)14-9-7-12(20)8-10-14/h2-10,23H,1H3,(H2,21,24,29)(H,22,26,28)