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

Systemtic Name: azepan-1-yl-[1-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-(2-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(2-methyl-5-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=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4CCC(CC4)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4CCC(CC4)C(=O)N5CCCCCC5

InChI

InChI=1S/C25H30N4OS/c1-18-26-23(22-21(17-31-24(22)27-18)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