N-[5-[(3,4-dimethylphenyl)methyl]-1,3-thiazol-2-yl]-7-methoxy-1-benzoxepine-4-carboxamide

Systemtic Name: N-[5-[(3,4-dimethylphenyl)methyl]-1,3-thiazol-2-yl]-7-methoxy-1-benzoxepine-4-carboxamide Openeye Name: N-[5-[(3,4-dimethylphenyl)methyl]thiazol-2-yl]-7-methoxy-1-benzoxepine-4-carboxamide CAS Name: N-[5-[(3,4-dimethylphenyl)methyl]-2-thiazolyl]-7-methoxy-1-benzoxepin-4-carboxamide IUPAC Name: N-[5-[(3,4-dimethylphenyl)methyl]-1,3-thiazol-2-yl]-7-methoxy-1-benzoxepine-4-carboxamide Traditional Name: N-[5-(3,4-dimethylbenzyl)thiazol-2-yl]-7-methoxy-1-benzoxepin-4-carboxamide Formula: C24H22N2O3S MolecularWeight: 418.50808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)OC)OC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)OC)OC=C3)C

InChI

InChI=1S/C24H22N2O3S/c1-15-4-5-17(10-16(15)2)11-21-14-25-24(30-21)26-23(27)18-8-9-29-22-7-6-20(28-3)13-19(22)12-18/h4-10,12-14H,11H2,1-3H3,(H,25,26,27)