azepan-1-yl-[1-(5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-(5-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(5-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(5-methyl-6-phenyl-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=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)N4CCCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)N4CCCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C25H30N4OS/c1-18-21-23(26-17-27-24(21)31-22(18)19-9-5-4-6-10-19)28-15-11-20(12-16-28)25(30)29-13-7-2-3-8-14-29/h4-6,9-10,17,20H,2-3,7-8,11-16H2,1H3