(5-ethylthiophen-2-yl)-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)methanone

Systemtic Name: (5-ethylthiophen-2-yl)-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)methanone Openeye Name: (5-ethyl-2-thienyl)-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)methanone CAS Name: (5-ethyl-2-thiophenyl)-[4-(2-pyrimidinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (5-ethylthiophen-2-yl)-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)methanone Traditional Name: (5-ethyl-2-thienyl)-[4-(2-pyrimidyl)-1,4-diazepan-1-yl]methanone Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)N2CCCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC1=CC=C(S1)C(=O)N2CCCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H20N4OS/c1-2-13-5-6-14(22-13)15(21)19-9-4-10-20(12-11-19)16-17-7-3-8-18-16/h3,5-8H,2,4,9-12H2,1H3