(2-methoxy-4-pyrrolidin-1-ylcarbothioyl-phenyl) 4-chloranylbenzoate

Systemtic Name: (2-methoxy-4-pyrrolidin-1-ylcarbothioyl-phenyl) 4-chloranylbenzoate Openeye Name: [2-methoxy-4-(pyrrolidine-1-carbothioyl)phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-methoxy-4-[1-pyrrolidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-(pyrrolidine-1-carbothioyl)phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-methoxy-4-(pyrrolidine-1-carbothioyl)phenyl] ester Formula: C19H18ClNO3S MolecularWeight: 375.86912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)N2CCCC2)OC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)N2CCCC2)OC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClNO3S/c1-23-17-12-14(18(25)21-10-2-3-11-21)6-9-16(17)24-19(22)13-4-7-15(20)8-5-13/h4-9,12H,2-3,10-11H2,1H3