4-azanylidene-1,3-dimethyl-6-[piperidin-3-ylmethyl(pyridin-4-ylmethyl)amino]-2-sulfanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanylidene-1,3-dimethyl-6-[piperidin-3-ylmethyl(pyridin-4-ylmethyl)amino]-2-sulfanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-imino-1,3-dimethyl-6-[3-piperidylmethyl(4-pyridylmethyl)amino]-2-thioxo-pyrimidine-5-carbonitrile CAS Name: 4-imino-1,3-dimethyl-6-[3-piperidinylmethyl(pyridin-4-ylmethyl)amino]-2-sulfanylidene-5-pyrimidinecarbonitrile IUPAC Name: 4-imino-1,3-dimethyl-6-[piperidin-3-ylmethyl(pyridin-4-ylmethyl)amino]-2-sulfanylidenepyrimidine-5-carbonitrile Traditional Name: 4-imino-1,3-dimethyl-6-[3-piperidylmethyl(4-pyridylmethyl)amino]-2-thioxo-pyrimidine-5-carbonitrile Formula: C19H25N7S MolecularWeight: 383.5137

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N)N(C1=S)C)C#N)N(CC2CCCNC2)CC3=CC=NC=C3

Isomeric SMILES

CN1C(=C(C(=N)N(C1=S)C)C#N)N(CC2CCCNC2)CC3=CC=NC=C3

InChI

InChI=1S/C19H25N7S/c1-24-17(21)16(10-20)18(25(2)19(24)27)26(12-14-5-8-22-9-6-14)13-15-4-3-7-23-11-15/h5-6,8-9,15,21,23H,3-4,7,11-13H2,1-2H3