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

Systemtic Name: azepan-1-yl-[5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: azepan-1-yl-[5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: 1-azepanyl-[5-methyl-4-(4-phenyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: azepan-1-yl-[5-methyl-4-(4-phenylpiperazino)thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)N5CCCCCC5

InChI

InChI=1S/C24H29N5OS/c1-18-20-22(28-15-13-27(14-16-28)19-9-5-4-6-10-19)25-17-26-23(20)31-21(18)24(30)29-11-7-2-3-8-12-29/h4-6,9-10,17H,2-3,7-8,11-16H2,1H3