ethyl 2-(diethylamino)-4-(phenylcarbamothioylamino)benzoate

Systemtic Name: ethyl 2-(diethylamino)-4-(phenylcarbamothioylamino)benzoate Openeye Name: ethyl 2-(diethylamino)-4-(phenylcarbamothioylamino)benzoate CAS Name: 4-[[anilino(sulfanylidene)methyl]amino]-2-(diethylamino)benzoic acid ethyl ester IUPAC Name: ethyl 2-(diethylamino)-4-(phenylcarbamothioylamino)benzoate Traditional Name: 2-(diethylamino)-4-(phenylthiocarbamoylamino)benzoic acid ethyl ester Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=CC(=C1)NC(=S)NC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCN(CC)C1=C(C=CC(=C1)NC(=S)NC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C20H25N3O2S/c1-4-23(5-2)18-14-16(12-13-17(18)19(24)25-6-3)22-20(26)21-15-10-8-7-9-11-15/h7-14H,4-6H2,1-3H3,(H2,21,22,26)