S-[3-(1,3-benzoxazol-2-yl)propyl] N-[(2-methoxyphenyl)carbonylamino]carbamothioate

Systemtic Name: S-[3-(1,3-benzoxazol-2-yl)propyl] N-[(2-methoxyphenyl)carbonylamino]carbamothioate Openeye Name: S-[3-(1,3-benzoxazol-2-yl)propyl] N-[(2-methoxybenzoyl)amino]carbamothioate CAS Name: N-[[(2-methoxyphenyl)-oxomethyl]amino]carbamothioic acid S-[3-(1,3-benzoxazol-2-yl)propyl] ester IUPAC Name: S-[3-(1,3-benzoxazol-2-yl)propyl] N-[(2-methoxybenzoyl)amino]carbamothioate Traditional Name: N-(o-anisoylamino)thiocarbamic acid S-[3-(1,3-benzoxazol-2-yl)propyl] ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NNC(=O)SCCCC2=NC3=CC=CC=C3O2

Isomeric SMILES

COC1=CC=CC=C1C(=O)NNC(=O)SCCCC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H19N3O4S/c1-25-15-9-4-2-7-13(15)18(23)21-22-19(24)27-12-6-11-17-20-14-8-3-5-10-16(14)26-17/h2-5,7-10H,6,11-12H2,1H3,(H,21,23)(H,22,24)