[1-[[4-[(2-methoxyphenyl)carbamoyl]phenyl]amino]-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate

Systemtic Name: [1-[[4-[(2-methoxyphenyl)carbamoyl]phenyl]amino]-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate Openeye Name: [2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-1-methyl-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [1-[4-[(2-methoxyanilino)-oxomethyl]anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-[(2-methoxyphenyl)carbamoyl]anilino]-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-keto-2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-1-methyl-ethyl] ester Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2OC)SC(=S)N3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2OC)SC(=S)N3CCCC3

InChI

InChI=1S/C22H25N3O3S2/c1-15(30-22(29)25-13-5-6-14-25)20(26)23-17-11-9-16(10-12-17)21(27)24-18-7-3-4-8-19(18)28-2/h3-4,7-12,15H,5-6,13-14H2,1-2H3,(H,23,26)(H,24,27)