2-[[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]methylamino]butan-1-ol

Systemtic Name: 2-[[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]methylamino]butan-1-ol Openeye Name: 2-[[1-(1,1-dioxothiolan-3-yl)-3,5-dimethyl-pyrazol-4-yl]methylamino]butan-1-ol CAS Name: 2-[[1-(1,1-dioxo-3-thiolanyl)-3,5-dimethyl-4-pyrazolyl]methylamino]-1-butanol IUPAC Name: 2-[[1-(1,1-dioxothiolan-3-yl)-3,5-dimethylpyrazol-4-yl]methylamino]butan-1-ol Traditional Name: 2-[[1-(1,1-diketothiolan-3-yl)-3,5-dimethyl-pyrazol-4-yl]methylamino]butan-1-ol Formula: C14H25N3O3S MolecularWeight: 315.4316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC1=C(N(N=C1C)C2CCS(=O)(=O)C2)C

Isomeric SMILES

CCC(CO)NCC1=C(N(N=C1C)C2CCS(=O)(=O)C2)C

InChI

InChI=1S/C14H25N3O3S/c1-4-12(8-18)15-7-14-10(2)16-17(11(14)3)13-5-6-21(19,20)9-13/h12-13,15,18H,4-9H2,1-3H3