6-chloranyl-N-[1-[(2-isocyanophenyl)methyl]piperidin-4-yl]-5-methyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-[1-[(2-isocyanophenyl)methyl]piperidin-4-yl]-5-methyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-chloro-N-[1-[(2-isocyanophenyl)methyl]-4-piperidyl]-5-methyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-chloro-N-[1-[(2-isocyanophenyl)methyl]-4-piperidinyl]-5-methyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-chloro-N-[1-[(2-isocyanophenyl)methyl]piperidin-4-yl]-5-methylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-chloro-5-methyl-thieno[2,3-d]pyrimidin-4-yl)-[1-(2-isocyanobenzyl)-4-piperidyl]amine Formula: C20H20ClN5S MolecularWeight: 397.9243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3CCN(CC3)CC4=CC=CC=C4[N+]#[C-])Cl

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3CCN(CC3)CC4=CC=CC=C4[N+]#[C-])Cl

InChI

InChI=1S/C20H20ClN5S/c1-13-17-19(23-12-24-20(17)27-18(13)21)25-15-7-9-26(10-8-15)11-14-5-3-4-6-16(14)22-2/h3-6,12,15H,7-11H2,1H3,(H,23,24,25)