[2-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate

Systemtic Name: [2-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate Openeye Name: [2-[(3-amino-3-oxo-propyl)-benzyl-amino]-2-oxo-ethyl] 2,4-dimethylthiazole-5-carboxylate CAS Name: 2,4-dimethyl-5-thiazolecarboxylic acid [2-[(3-amino-3-oxopropyl)-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-amino-3-oxopropyl)-benzylamino]-2-oxoethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate Traditional Name: 2,4-dimethylthiazole-5-carboxylic acid [2-[(3-amino-3-keto-propyl)-benzyl-amino]-2-keto-ethyl] ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(=O)OCC(=O)N(CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(SC(=N1)C)C(=O)OCC(=O)N(CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C18H21N3O4S/c1-12-17(26-13(2)20-12)18(24)25-11-16(23)21(9-8-15(19)22)10-14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3,(H2,19,22)