4-[5-methyl-4-[[(1S)-1-thiophen-2-ylethyl]amino]thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[5-methyl-4-[[(1S)-1-thiophen-2-ylethyl]amino]thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[5-methyl-4-[[(1S)-1-(2-thienyl)ethyl]amino]thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carbaldehyde CAS Name: 4-[[5-methyl-4-[[(1S)-1-thiophen-2-ylethyl]amino]-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[5-methyl-4-[[(1S)-1-thiophen-2-ylethyl]amino]thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carbaldehyde Traditional Name: 4-[5-methyl-4-[[(1S)-1-(2-thienyl)ethyl]amino]thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carbaldehyde Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC(C)C3=CC=CS3)C(=O)N4CCN(CC4)C=O

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N[C@@H](C)C3=CC=CS3)C(=O)N4CCN(CC4)C=O

InChI

InChI=1S/C19H21N5O2S2/c1-12-15-17(22-13(2)14-4-3-9-27-14)20-10-21-18(15)28-16(12)19(26)24-7-5-23(11-25)6-8-24/h3-4,9-11,13H,5-8H2,1-2H3,(H,20,21,22)/t13-/m0/s1