ethyl 2-azanyl-4-[(phenylmethyl)-propan-2-yl-amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[(phenylmethyl)-propan-2-yl-amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-amino-4-[benzyl(isopropyl)amino]thiazole-5-carboxylate CAS Name: 2-amino-4-[(phenylmethyl)-propan-2-ylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[benzyl(propan-2-yl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-amino-4-[benzyl(isopropyl)amino]thiazole-5-carboxylic acid ethyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N)N(CC2=CC=CC=C2)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N)N(CC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C16H21N3O2S/c1-4-21-15(20)13-14(18-16(17)22-13)19(11(2)3)10-12-8-6-5-7-9-12/h5-9,11H,4,10H2,1-3H3,(H2,17,18)