2-diethylaminoethyl 4-(carbamothioylamino)benzoate

Systemtic Name: 2-diethylaminoethyl 4-(carbamothioylamino)benzoate Openeye Name: 2-diethylaminoethyl 4-(carbamothioylamino)benzoate CAS Name: 4-(carbamothioylamino)benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-(carbamothioylamino)benzoate Traditional Name: 4-thioureidobenzoic acid 2-diethylaminoethyl ester Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)N

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)N

InChI

InChI=1S/C14H21N3O2S/c1-3-17(4-2)9-10-19-13(18)11-5-7-12(8-6-11)16-14(15)20/h5-8H,3-4,9-10H2,1-2H3,(H3,15,16,20)