[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)cyclohexyl]-(4-ethoxy-1,3-benzothiazol-2-yl)methanone

Systemtic Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)cyclohexyl]-(4-ethoxy-1,3-benzothiazol-2-yl)methanone Openeye Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)cyclohexyl]-(4-ethoxy-1,3-benzothiazol-2-yl)methanone CAS Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)cyclohexyl]-(4-ethoxy-1,3-benzothiazol-2-yl)methanone IUPAC Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)cyclohexyl]-(4-ethoxy-1,3-benzothiazol-2-yl)methanone Traditional Name: [4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)cyclohexyl]-(4-ethoxy-1,3-benzothiazol-2-yl)methanone Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)C(=O)C3CCC(CC3)NCC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)C(=O)C3CCC(CC3)NCC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H28N2O4S/c1-2-29-20-4-3-5-22-23(20)27-25(32-22)24(28)17-7-9-18(10-8-17)26-15-16-6-11-19-21(14-16)31-13-12-30-19/h3-6,11,14,17-18,26H,2,7-10,12-13,15H2,1H3