(7-ethoxy-1-benzofuran-2-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (7-ethoxy-1-benzofuran-2-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (7-ethoxybenzofuran-2-yl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (7-ethoxy-2-benzofuranyl)-[4-(2-thiazolylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (7-ethoxy-1-benzofuran-2-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (7-ethoxybenzofuran-2-yl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Formula: C20H23N3O3S MolecularWeight: 385.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=C2)C(=O)N3CCCN(CC3)CC4=NC=CS4

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=C2)C(=O)N3CCCN(CC3)CC4=NC=CS4

InChI

InChI=1S/C20H23N3O3S/c1-2-25-16-6-3-5-15-13-17(26-19(15)16)20(24)23-9-4-8-22(10-11-23)14-18-21-7-12-27-18/h3,5-7,12-13H,2,4,8-11,14H2,1H3