[1-[3-azanyl-2,6-bis(prop-2-enyl)-2H-1,3,5-triazin-4-yl]piperidin-4-yl] 1-benzothiophene-2-carboxylate

Systemtic Name: [1-[3-azanyl-2,6-bis(prop-2-enyl)-2H-1,3,5-triazin-4-yl]piperidin-4-yl] 1-benzothiophene-2-carboxylate Openeye Name: [1-(2,6-diallyl-3-amino-2H-1,3,5-triazin-4-yl)-4-piperidyl] benzothiophene-2-carboxylate CAS Name: 1-benzothiophene-2-carboxylic acid [1-[3-amino-2,6-bis(prop-2-enyl)-2H-1,3,5-triazin-4-yl]-4-piperidinyl] ester IUPAC Name: [1-[3-amino-2,6-bis(prop-2-enyl)-2H-1,3,5-triazin-4-yl]piperidin-4-yl] 1-benzothiophene-2-carboxylate Traditional Name: benzothiophene-2-carboxylic acid [1-(2,6-diallyl-3-amino-2H-s-triazin-4-yl)-4-piperidyl] ester Formula: C23H27N5O2S MolecularWeight: 437.55778

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1N=C(N=C(N1N)N2CCC(CC2)OC(=O)C3=CC4=CC=CC=C4S3)CC=C

Isomeric SMILES

C=CCC1N=C(N=C(N1N)N2CCC(CC2)OC(=O)C3=CC4=CC=CC=C4S3)CC=C

InChI

InChI=1S/C23H27N5O2S/c1-3-7-20-25-21(8-4-2)28(24)23(26-20)27-13-11-17(12-14-27)30-22(29)19-15-16-9-5-6-10-18(16)31-19/h3-6,9-10,15,17,21H,1-2,7-8,11-14,24H2