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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)OC)OC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)OC)OC=C3

InChI

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