3-[(2-azanyl-1,3-thiazol-5-yl)sulfanyl]azepan-2-one

Systemtic Name: 3-[(2-azanyl-1,3-thiazol-5-yl)sulfanyl]azepan-2-one Openeye Name: 3-(2-aminothiazol-5-yl)sulfanylazepan-2-one CAS Name: 3-[(2-amino-5-thiazolyl)thio]-2-azepanone IUPAC Name: 3-[(2-amino-1,3-thiazol-5-yl)sulfanyl]azepan-2-one Traditional Name: 3-[(2-aminothiazol-5-yl)thio]azepan-2-one Formula: C9H13N3OS2 MolecularWeight: 243.34902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=CN=C(S2)N

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=CN=C(S2)N

InChI

InChI=1S/C9H13N3OS2/c10-9-12-5-7(15-9)14-6-3-1-2-4-11-8(6)13/h5-6H,1-4H2,(H2,10,12)(H,11,13)