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

Systemtic Name: azepan-1-yl-[5-methyl-4-(prop-2-enylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: [4-(allylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-(azepan-1-yl)methanone CAS Name: 1-azepanyl-[5-methyl-4-(prop-2-enylamino)-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-4-(prop-2-enylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: [4-(allylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-(azepan-1-yl)methanone Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC=C)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC=C)C(=O)N3CCCCCC3

InChI

InChI=1S/C17H22N4OS/c1-3-8-18-15-13-12(2)14(23-16(13)20-11-19-15)17(22)21-9-6-4-5-7-10-21/h3,11H,1,4-10H2,2H3,(H,18,19,20)