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

Systemtic Name: [4-(ethylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-(4-phenylazepan-1-yl)methanone Openeye Name: [4-(ethylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-(4-phenylazepan-1-yl)methanone CAS Name: [4-(ethylamino)-5-methyl-6-thieno[2,3-d]pyrimidinyl]-(4-phenyl-1-azepanyl)methanone IUPAC Name: [4-(ethylamino)-5-methylthieno[2,3-d]pyrimidin-6-yl]-(4-phenylazepan-1-yl)methanone Traditional Name: [4-(ethylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-(4-phenylazepan-1-yl)methanone Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=C(SC2=NC=N1)C(=O)N3CCCC(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CCNC1=C2C(=C(SC2=NC=N1)C(=O)N3CCCC(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H26N4OS/c1-3-23-20-18-15(2)19(28-21(18)25-14-24-20)22(27)26-12-7-10-17(11-13-26)16-8-5-4-6-9-16/h4-6,8-9,14,17H,3,7,10-13H2,1-2H3,(H,23,24,25)