N-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine

Systemtic Name: N-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine Openeye Name: N-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(Z)-2-pyridylmethyleneamino]thiazol-2-imine CAS Name: N-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(Z)-2-pyridinylmethylideneamino]-2-thiazolimine IUPAC Name: N-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine Traditional Name: butyl-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(Z)-2-pyridylmethyleneamino]-4-thiazolin-2-ylidene]amine Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCCO3)N=CC4=CC=CC=N4

Isomeric SMILES

CCCCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCCO3)/N=C\C4=CC=CC=N4

InChI

InChI=1S/C21H22N4O2S/c1-2-3-9-23-21-25(24-14-17-6-4-5-10-22-17)18(15-28-21)16-7-8-19-20(13-16)27-12-11-26-19/h4-8,10,13-15H,2-3,9,11-12H2,1H3/b23-21?,24-14-