azepan-1-yl-[1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]-4-piperidyl]methanone Formula: C25H30N4OS MolecularWeight: 434.5969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CCC(CC4)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CCC(CC4)C(=O)N5CCCCCC5

InChI

InChI=1S/C25H30N4OS/c1-18-6-8-19(9-7-18)21-16-31-24-22(21)23(26-17-27-24)28-14-10-20(11-15-28)25(30)29-12-4-2-3-5-13-29/h6-9,16-17,20H,2-5,10-15H2,1H3