3,4-dimethoxy-N-[[1-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrol-2-yl]methyl]aniline

Systemtic Name: 3,4-dimethoxy-N-[[1-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrol-2-yl]methyl]aniline Openeye Name: 3,4-dimethoxy-N-[[1-[5-(1-piperidyl)-1,3,4-thiadiazol-2-yl]pyrrol-2-yl]methyl]aniline CAS Name: 3,4-dimethoxy-N-[[1-[5-(1-piperidinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolyl]methyl]aniline IUPAC Name: 3,4-dimethoxy-N-[[1-(5-piperidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrol-2-yl]methyl]aniline Traditional Name: (3,4-dimethoxyphenyl)-[[1-(5-piperidino-1,3,4-thiadiazol-2-yl)pyrrol-2-yl]methyl]amine Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCC2=CC=CN2C3=NN=C(S3)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NCC2=CC=CN2C3=NN=C(S3)N4CCCCC4)OC

InChI

InChI=1S/C20H25N5O2S/c1-26-17-9-8-15(13-18(17)27-2)21-14-16-7-6-12-25(16)20-23-22-19(28-20)24-10-4-3-5-11-24/h6-9,12-13,21H,3-5,10-11,14H2,1-2H3