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

Systemtic Name: azepan-1-yl-[5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: azepan-1-yl-[5-methyl-4-(N-methylanilino)thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: 1-azepanyl-[5-methyl-4-(N-methylanilino)-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-4-(N-methylanilino)thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: azepan-1-yl-[5-methyl-4-(N-methylanilino)thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N(C)C3=CC=CC=C3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N(C)C3=CC=CC=C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C21H24N4OS/c1-15-17-19(24(2)16-10-6-5-7-11-16)22-14-23-20(17)27-18(15)21(26)25-12-8-3-4-9-13-25/h5-7,10-11,14H,3-4,8-9,12-13H2,1-2H3