[1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate

Systemtic Name: [1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-1-methyl-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [1-(1,3-benzothiazol-2-ylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1,3-benzothiazol-2-ylamino)-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-(1,3-benzothiazol-2-ylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H17N3OS3 MolecularWeight: 351.50998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=CC=CC=C2S1)SC(=S)N3CCCC3

Isomeric SMILES

CC(C(=O)NC1=NC2=CC=CC=C2S1)SC(=S)N3CCCC3

InChI

InChI=1S/C15H17N3OS3/c1-10(21-15(20)18-8-4-5-9-18)13(19)17-14-16-11-6-2-3-7-12(11)22-14/h2-3,6-7,10H,4-5,8-9H2,1H3,(H,16,17,19)