4-butoxy-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-butoxy-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-butoxy-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-butoxy-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-butoxy-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-butoxy-N-(3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N=C2N(C3=CC=CC=C3S2)CC#C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N=C2N(C3=CC=CC=C3S2)CC#C

InChI

InChI=1S/C21H20N2O2S/c1-3-5-15-25-17-12-10-16(11-13-17)20(24)22-21-23(14-4-2)18-8-6-7-9-19(18)26-21/h2,6-13H,3,5,14-15H2,1H3