4-azanylidene-6-[2-(3,4-dichlorophenyl)ethyl-piperidin-3-yl-amino]-1,3-dimethyl-2-sulfanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanylidene-6-[2-(3,4-dichlorophenyl)ethyl-piperidin-3-yl-amino]-1,3-dimethyl-2-sulfanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-[2-(3,4-dichlorophenyl)ethyl-(3-piperidyl)amino]-6-imino-1,3-dimethyl-2-thioxo-pyrimidine-5-carbonitrile CAS Name: 4-[2-(3,4-dichlorophenyl)ethyl-(3-piperidinyl)amino]-6-imino-1,3-dimethyl-2-sulfanylidene-5-pyrimidinecarbonitrile IUPAC Name: 4-[2-(3,4-dichlorophenyl)ethyl-piperidin-3-ylamino]-6-imino-1,3-dimethyl-2-sulfanylidenepyrimidine-5-carbonitrile Traditional Name: 4-[2-(3,4-dichlorophenyl)ethyl-(3-piperidyl)amino]-6-imino-1,3-dimethyl-2-thioxo-pyrimidine-5-carbonitrile Formula: C20H24Cl2N6S MolecularWeight: 451.41576

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N)N(C1=S)C)C#N)N(CCC2=CC(=C(C=C2)Cl)Cl)C3CCCNC3

Isomeric SMILES

CN1C(=C(C(=N)N(C1=S)C)C#N)N(CCC2=CC(=C(C=C2)Cl)Cl)C3CCCNC3

InChI

InChI=1S/C20H24Cl2N6S/c1-26-18(24)15(11-23)19(27(2)20(26)29)28(14-4-3-8-25-12-14)9-7-13-5-6-16(21)17(22)10-13/h5-6,10,14,24-25H,3-4,7-9,12H2,1-2H3