[2-[(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate

Systemtic Name: [2-[(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)amino]-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate Openeye Name: [2-(2-isopropoxy-5-morpholinosulfonyl-anilino)-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [2-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyanilino]-2-oxoethyl] ester IUPAC Name: [2-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyanilino)-2-oxoethyl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-(2-isopropoxy-5-morpholinosulfonyl-anilino)-2-keto-ethyl] ester Formula: C20H29N3O5S3 MolecularWeight: 487.65636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC(=S)N3CCCC3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC(=S)N3CCCC3

InChI

InChI=1S/C20H29N3O5S3/c1-15(2)28-18-6-5-16(31(25,26)23-9-11-27-12-10-23)13-17(18)21-19(24)14-30-20(29)22-7-3-4-8-22/h5-6,13,15H,3-4,7-12,14H2,1-2H3,(H,21,24)