carbamothioyl 2-(2-aminophenyl)-2-azanyl-3-[(5-methylfuran-2-yl)methyl]pyrrolidine-1-carboxylate

Systemtic Name: carbamothioyl 2-(2-aminophenyl)-2-azanyl-3-[(5-methylfuran-2-yl)methyl]pyrrolidine-1-carboxylate Openeye Name: carbamothioyl 2-amino-2-(2-aminophenyl)-3-[(5-methyl-2-furyl)methyl]pyrrolidine-1-carboxylate CAS Name: 2-amino-2-(2-aminophenyl)-3-[(5-methyl-2-furanyl)methyl]-1-pyrrolidinecarboxylic acid carbamothioyl ester IUPAC Name: carbamothioyl 2-amino-2-(2-aminophenyl)-3-[(5-methylfuran-2-yl)methyl]pyrrolidine-1-carboxylate Traditional Name: 2-amino-2-(2-aminophenyl)-3-[(5-methyl-2-furyl)methyl]pyrrolidine-1-carboxylic acid thiocarbamoyl ester Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CC2CCN(C2(C3=CC=CC=C3N)N)C(=O)OC(=S)N

Isomeric SMILES

CC1=CC=C(O1)CC2CCN(C2(C3=CC=CC=C3N)N)C(=O)OC(=S)N

InChI

InChI=1S/C18H22N4O3S/c1-11-6-7-13(24-11)10-12-8-9-22(17(23)25-16(20)26)18(12,21)14-4-2-3-5-15(14)19/h2-7,12H,8-10,19,21H2,1H3,(H2,20,26)