methyl 1-azanyl-3-phenyl-pyrrolo[2,1-b][1,3]benzothiazole-2-carboxylate

Systemtic Name: methyl 1-azanyl-3-phenyl-pyrrolo[2,1-b][1,3]benzothiazole-2-carboxylate Openeye Name: methyl 1-amino-3-phenyl-pyrrolo[2,1-b][1,3]benzothiazole-2-carboxylate CAS Name: 1-amino-3-phenyl-2-pyrrolo[2,1-b][1,3]benzothiazolecarboxylic acid methyl ester IUPAC Name: methyl 1-amino-3-phenylpyrrolo[2,1-b][1,3]benzothiazole-2-carboxylate Traditional Name: 1-amino-3-phenyl-pyrrolo[2,1-b][1,3]benzothiazole-2-carboxylic acid methyl ester Formula: C18H14N2O2S MolecularWeight: 322.38096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N2C3=CC=CC=C3SC2=C1C4=CC=CC=C4)N

Isomeric SMILES

COC(=O)C1=C(N2C3=CC=CC=C3SC2=C1C4=CC=CC=C4)N

InChI

InChI=1S/C18H14N2O2S/c1-22-18(21)15-14(11-7-3-2-4-8-11)17-20(16(15)19)12-9-5-6-10-13(12)23-17/h2-10H,19H2,1H3