N-methyl-5-[5-phenyl-2-(piperidin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-methyl-5-[5-phenyl-2-(piperidin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-methyl-5-[5-phenyl-2-(1-piperidylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: N-methyl-5-[[5-phenyl-2-(1-piperidinylmethyl)-4-thieno[2,3-d]pyrimidinyl]thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-methyl-5-[5-phenyl-2-(piperidin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: methyl-[5-[[5-phenyl-2-(piperidinomethyl)thieno[2,3-d]pyrimidin-4-yl]thio]-1,3,4-thiadiazol-2-yl]amine Formula: C21H22N6S3 MolecularWeight: 454.63458

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN=C(S1)SC2=NC(=NC3=C2C(=CS3)C4=CC=CC=C4)CN5CCCCC5

Isomeric SMILES

CNC1=NN=C(S1)SC2=NC(=NC3=C2C(=CS3)C4=CC=CC=C4)CN5CCCCC5

InChI

InChI=1S/C21H22N6S3/c1-22-20-25-26-21(30-20)29-19-17-15(14-8-4-2-5-9-14)13-28-18(17)23-16(24-19)12-27-10-6-3-7-11-27/h2,4-5,8-9,13H,3,6-7,10-12H2,1H3,(H,22,25)