(4-cyclohexyl-1,4-diazepan-1-yl)-(6-thiomorpholin-4-ylpyridin-3-yl)methanone

Systemtic Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(6-thiomorpholin-4-ylpyridin-3-yl)methanone Openeye Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(6-thiomorpholino-3-pyridyl)methanone CAS Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(6-thiomorpholin-4-yl-3-pyridinyl)methanone IUPAC Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(6-thiomorpholin-4-ylpyridin-3-yl)methanone Traditional Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(6-thiomorpholino-3-pyridyl)methanone Formula: C21H32N4OS MolecularWeight: 388.56998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCCN(CC2)C(=O)C3=CN=C(C=C3)N4CCSCC4

Isomeric SMILES

C1CCC(CC1)N2CCCN(CC2)C(=O)C3=CN=C(C=C3)N4CCSCC4

InChI

InChI=1S/C21H32N4OS/c26-21(18-7-8-20(22-17-18)24-13-15-27-16-14-24)25-10-4-9-23(11-12-25)19-5-2-1-3-6-19/h7-8,17,19H,1-6,9-16H2