1-[(E)-1-[4-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]ethylideneamino]thiourea

Systemtic Name: 1-[(E)-1-[4-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]ethylideneamino]thiourea Openeye Name: [(E)-1-[4-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]ethylideneamino]thiourea CAS Name: [(E)-1-[4-methyl-2-(4-methyl-1-piperazinyl)-5-pyrimidinyl]ethylideneamino]thiourea IUPAC Name: [(E)-1-[4-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]ethylideneamino]thiourea Traditional Name: [(E)-1-[4-methyl-2-(4-methylpiperazino)pyrimidin-5-yl]ethylideneamino]thiourea Formula: C13H21N7S MolecularWeight: 307.41774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=NNC(=S)N)C)N2CCN(CC2)C

Isomeric SMILES

CC1=NC(=NC=C1/C(=N/NC(=S)N)/C)N2CCN(CC2)C

InChI

InChI=1S/C13H21N7S/c1-9-11(10(2)17-18-12(14)21)8-15-13(16-9)20-6-4-19(3)5-7-20/h8H,4-7H2,1-3H3,(H3,14,18,21)/b17-10+