N-(4-methoxyphenyl)-4-(4-piperidin-1-ylsulfonylphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine

Systemtic Name: N-(4-methoxyphenyl)-4-(4-piperidin-1-ylsulfonylphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine Openeye Name: N-(4-methoxyphenyl)-4-[4-(1-piperidylsulfonyl)phenyl]-3-(3-pyridylmethyl)thiazol-2-imine CAS Name: N-(4-methoxyphenyl)-4-[4-(1-piperidinylsulfonyl)phenyl]-3-(3-pyridinylmethyl)-2-thiazolimine IUPAC Name: N-(4-methoxyphenyl)-4-(4-piperidin-1-ylsulfonylphenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine Traditional Name: (4-methoxyphenyl)-[4-(4-piperidinosulfonylphenyl)-3-(3-pyridylmethyl)-4-thiazolin-2-ylidene]amine Formula: C27H28N4O3S2 MolecularWeight: 520.66622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)CC5=CN=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)CC5=CN=CC=C5

InChI

InChI=1S/C27H28N4O3S2/c1-34-24-11-9-23(10-12-24)29-27-31(19-21-6-5-15-28-18-21)26(20-35-27)22-7-13-25(14-8-22)36(32,33)30-16-3-2-4-17-30/h5-15,18,20H,2-4,16-17,19H2,1H3