N-[(Z)-1-(1,3-benzothiazol-2-yl)ethylideneamino]-4-butoxy-3-methoxy-benzamide

Systemtic Name: N-[(Z)-1-(1,3-benzothiazol-2-yl)ethylideneamino]-4-butoxy-3-methoxy-benzamide Openeye Name: N-[(Z)-1-(1,3-benzothiazol-2-yl)ethylideneamino]-4-butoxy-3-methoxy-benzamide CAS Name: N-[(Z)-1-(1,3-benzothiazol-2-yl)ethylideneamino]-4-butoxy-3-methoxybenzamide IUPAC Name: N-[(Z)-1-(1,3-benzothiazol-2-yl)ethylideneamino]-4-butoxy-3-methoxybenzamide Traditional Name: N-[(Z)-1-(1,3-benzothiazol-2-yl)ethylideneamino]-4-butoxy-3-methoxy-benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NN=C(C)C2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N/N=C(/C)\C2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C21H23N3O3S/c1-4-5-12-27-17-11-10-15(13-18(17)26-3)20(25)24-23-14(2)21-22-16-8-6-7-9-19(16)28-21/h6-11,13H,4-5,12H2,1-3H3,(H,24,25)/b23-14-