[1-oxidanylidene-1-[(phenylmethyl)carbamoylamino]propan-2-yl] 2-azanyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)carbamoylamino]propan-2-yl] 2-azanyl-1,3-benzothiazole-6-carboxylate Openeye Name: [2-(benzylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2-amino-1,3-benzothiazole-6-carboxylate CAS Name: 2-amino-1,3-benzothiazole-6-carboxylic acid [1-oxo-1-[[oxo-[(phenylmethyl)amino]methyl]amino]propan-2-yl] ester IUPAC Name: [1-(benzylcarbamoylamino)-1-oxopropan-2-yl] 2-amino-1,3-benzothiazole-6-carboxylate Traditional Name: 2-amino-1,3-benzothiazole-6-carboxylic acid [2-(benzylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)OC(=O)C2=CC3=C(C=C2)N=C(S3)N

Isomeric SMILES

CC(C(=O)NC(=O)NCC1=CC=CC=C1)OC(=O)C2=CC3=C(C=C2)N=C(S3)N

InChI

InChI=1S/C19H18N4O4S/c1-11(16(24)23-19(26)21-10-12-5-3-2-4-6-12)27-17(25)13-7-8-14-15(9-13)28-18(20)22-14/h2-9,11H,10H2,1H3,(H2,20,22)(H2,21,23,24,26)