1-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(azepan-1-yl)propan-2-one

Systemtic Name: 1-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(azepan-1-yl)propan-2-one Openeye Name: 1-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(azepan-1-yl)propan-2-one CAS Name: 1-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-3-(1-azepanyl)-2-propanone IUPAC Name: 1-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(azepan-1-yl)propan-2-one Traditional Name: 1-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-3-(azepan-1-yl)acetone Formula: C11H18N4OS2 MolecularWeight: 286.41682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(=O)CSC2=NN=C(S2)N

Isomeric SMILES

C1CCCN(CC1)CC(=O)CSC2=NN=C(S2)N

InChI

InChI=1S/C11H18N4OS2/c12-10-13-14-11(18-10)17-8-9(16)7-15-5-3-1-2-4-6-15/h1-8H2,(H2,12,13)