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methyl 2-(3-butoxyphenyl)carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate

methyl 2-(3-butoxyphenyl)carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate

Systemtic Name:methyl 2-(3-butoxyphenyl)carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate
Openeye Name:methyl 2-(3-butoxybenzoyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylate
CAS Name:2-[(3-butoxyphenyl)-oxomethyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester
IUPAC Name:methyl 2-(3-butoxybenzoyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylate
Traditional Name:2-(3-butoxybenzoyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester
Formula: C22H24N2O4S
MolecularWeight: 412.50196
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OC)CC


Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OC)CC


InChI

InChI=1S/C22H24N2O4S/c1-4-6-12-28-17-9-7-8-15(13-17)20(25)23-22-24(5-2)18-11-10-16(21(26)27-3)14-19(18)29-22/h7-11,13-14H,4-6,12H2,1-3H3


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