(3S)-3-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]azepan-2-one

Systemtic Name: (3S)-3-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]azepan-2-one Openeye Name: (3S)-3-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]azepan-2-one CAS Name: (3S)-3-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-2-azepanone IUPAC Name: (3S)-3-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]azepan-2-one Traditional Name: (3S)-3-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]azepan-2-one Formula: C14H23N5OS MolecularWeight: 309.43032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SC3CCCCNC3=O

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)S[C@H]3CCCCNC3=O

InChI

InChI=1S/C14H23N5OS/c15-19-12(10-6-2-1-3-7-10)17-18-14(19)21-11-8-4-5-9-16-13(11)20/h10-11H,1-9,15H2,(H,16,20)/t11-/m0/s1