2-[4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-(6-phenyl-4-thieno[2,3-d]pyrimidinyl)-1,4-diazepan-1-yl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]acetamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCCN(CC1)C2=C3C=C(SC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)CN1CCCN(CC1)C2=C3C=C(SC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C22H27N5OS/c1-16(2)25-20(28)14-26-9-6-10-27(12-11-26)21-18-13-19(17-7-4-3-5-8-17)29-22(18)24-15-23-21/h3-5,7-8,13,15-16H,6,9-12,14H2,1-2H3,(H,25,28)