6-[[5-[(4-methoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-[[5-[(4-methoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 6-[[5-[(4-methoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 6-[[5-[(4-methoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 6-[[5-[(4-methoxyphenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]pyridine-3-carbonitrile Traditional Name: 6-[[5-(p-anisylamino)-1,3,4-thiadiazol-2-yl]thio]nicotinonitrile Formula: C16H13N5OS2 MolecularWeight: 355.43732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NN=C(S2)SC3=NC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NN=C(S2)SC3=NC=C(C=C3)C#N

InChI

InChI=1S/C16H13N5OS2/c1-22-13-5-2-11(3-6-13)9-19-15-20-21-16(24-15)23-14-7-4-12(8-17)10-18-14/h2-7,10H,9H2,1H3,(H,19,20)