4,6-dimethyl-N-[(Z)-(5-piperazin-4-ium-1-ylthiophen-2-yl)methylideneamino]pyrimidin-2-amine

Systemtic Name: 4,6-dimethyl-N-[(Z)-(5-piperazin-4-ium-1-ylthiophen-2-yl)methylideneamino]pyrimidin-2-amine Openeye Name: 4,6-dimethyl-N-[(Z)-(5-piperazin-4-ium-1-yl-2-thienyl)methyleneamino]pyrimidin-2-amine CAS Name: 4,6-dimethyl-N-[(Z)-[5-(1-piperazin-4-iumyl)-2-thiophenyl]methylideneamino]-2-pyrimidinamine IUPAC Name: 4,6-dimethyl-N-[(Z)-(5-piperazin-4-ium-1-ylthiophen-2-yl)methylideneamino]pyrimidin-2-amine Traditional Name: (4,6-dimethylpyrimidin-2-yl)-[(Z)-(5-piperazin-4-ium-1-yl-2-thienyl)methyleneamino]amine Formula: C15H21N6S+ MolecularWeight: 317.43244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NN=CC2=CC=C(S2)N3CC[NH2+]CC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N/N=C\C2=CC=C(S2)N3CC[NH2+]CC3)C

InChI

InChI=1S/C15H20N6S/c1-11-9-12(2)19-15(18-11)20-17-10-13-3-4-14(22-13)21-7-5-16-6-8-21/h3-4,9-10,16H,5-8H2,1-2H3,(H,18,19,20)/p+1/b17-10-