2-(dimethylamino)ethanamide; ethyl N-[(3-butylphenyl)carbamothioyl]carbamate; hydrochloride

Systemtic Name: 2-(dimethylamino)ethanamide; ethyl N-[(3-butylphenyl)carbamothioyl]carbamate; hydrochloride Openeye Name: 2-(dimethylamino)acetamide; ethyl N-[(3-butylphenyl)carbamothioyl]carbamate; hydrochloride CAS Name: N-[(3-butylanilino)-sulfanylidenemethyl]carbamic acid ethyl ester; 2-(dimethylamino)acetamide; hydrochloride IUPAC Name: 2-(dimethylamino)acetamide; ethyl N-[(3-butylphenyl)carbamothioyl]carbamate; hydrochloride Traditional Name: N-[(3-butylphenyl)thiocarbamoyl]carbamic acid ethyl ester; 2-(dimethylamino)acetamide; hydrochloride Formula: C18H31ClN4O3S MolecularWeight: 418.98174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)NC(=S)NC(=O)OCC.CN(C)CC(=O)N.Cl

Isomeric SMILES

CCCCC1=CC(=CC=C1)NC(=S)NC(=O)OCC.CN(C)CC(=O)N.Cl

InChI

InChI=1S/C14H20N2O2S.C4H10N2O.ClH/c1-3-5-7-11-8-6-9-12(10-11)15-13(19)16-14(17)18-4-2;1-6(2)3-4(5)7;/h6,8-10H,3-5,7H2,1-2H3,(H2,15,16,17,19);3H2,1-2H3,(H2,5,7);1H