ethyl 1-[[(2-azanyl-6-methyl-7-propan-2-yl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropane-1-carboxylate

Systemtic Name: ethyl 1-[[(2-azanyl-6-methyl-7-propan-2-yl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropane-1-carboxylate Openeye Name: ethyl 1-[[(2-amino-7-isopropyl-6-methyl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropanecarboxylate CAS Name: 1-[[(2-amino-6-methyl-7-propan-2-yl-1,3-benzothiazol-4-yl)oxy-phenoxyphosphoryl]amino]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[(2-amino-6-methyl-7-propan-2-yl-1,3-benzothiazol-4-yl)oxy-phenoxyphosphoryl]amino]cyclopropane-1-carboxylate Traditional Name: 1-[[(2-amino-7-isopropyl-6-methyl-1,3-benzothiazol-4-yl)oxy-phenoxy-phosphoryl]amino]cyclopropanecarboxylic acid ethyl ester Formula: C23H28N3O5PS MolecularWeight: 489.524281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC1)NP(=O)(OC2=CC=CC=C2)OC3=C4C(=C(C(=C3)C)C(C)C)SC(=N4)N

Isomeric SMILES

CCOC(=O)C1(CC1)NP(=O)(OC2=CC=CC=C2)OC3=C4C(=C(C(=C3)C)C(C)C)SC(=N4)N

InChI

InChI=1S/C23H28N3O5PS/c1-5-29-21(27)23(11-12-23)26-32(28,30-16-9-7-6-8-10-16)31-17-13-15(4)18(14(2)3)20-19(17)25-22(24)33-20/h6-10,13-14H,5,11-12H2,1-4H3,(H2,24,25)(H,26,28)