methyl 4-(1,3-benzothiazol-2-yl)-2-methyl-5-(propylcarbamoylamino)furan-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzothiazol-2-yl)-2-methyl-5-(propylcarbamoylamino)furan-3-carboxylate Openeye Name: methyl 4-(1,3-benzothiazol-2-yl)-2-methyl-5-(propylcarbamoylamino)furan-3-carboxylate CAS Name: 4-(1,3-benzothiazol-2-yl)-2-methyl-5-[[oxo(propylamino)methyl]amino]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzothiazol-2-yl)-2-methyl-5-(propylcarbamoylamino)furan-3-carboxylate Traditional Name: 4-(1,3-benzothiazol-2-yl)-2-methyl-5-(propylcarbamoylamino)furan-3-carboxylic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=C(C(=C(O1)C)C(=O)OC)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCNC(=O)NC1=C(C(=C(O1)C)C(=O)OC)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H19N3O4S/c1-4-9-19-18(23)21-15-14(13(10(2)25-15)17(22)24-3)16-20-11-7-5-6-8-12(11)26-16/h5-8H,4,9H2,1-3H3,(H2,19,21,23)