N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-7-methoxy-1-benzofuran-2-carboxamide

Systemtic Name: N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-7-methoxy-1-benzofuran-2-carboxamide Openeye Name: N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-7-methoxy-benzofuran-2-carboxamide CAS Name: N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-7-methoxy-2-benzofurancarboxamide IUPAC Name: N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-7-methoxy-1-benzofuran-2-carboxamide Traditional Name: N-(6-butyl-3-propargyl-1,3-benzothiazol-2-ylidene)-7-methoxy-coumarilamide Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(O3)C(=CC=C4)OC)S2)CC#C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(O3)C(=CC=C4)OC)S2)CC#C

InChI

InChI=1S/C24H22N2O3S/c1-4-6-8-16-11-12-18-21(14-16)30-24(26(18)13-5-2)25-23(27)20-15-17-9-7-10-19(28-3)22(17)29-20/h2,7,9-12,14-15H,4,6,8,13H2,1,3H3