7-chloranyl-N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-9-methoxy-1-benzoxepine-4-carboxamide

Systemtic Name: 7-chloranyl-N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-9-methoxy-1-benzoxepine-4-carboxamide Openeye Name: 7-chloro-N-[5-[(4-ethylphenyl)methyl]thiazol-2-yl]-9-methoxy-1-benzoxepine-4-carboxamide CAS Name: 7-chloro-N-[5-[(4-ethylphenyl)methyl]-2-thiazolyl]-9-methoxy-1-benzoxepin-4-carboxamide IUPAC Name: 7-chloro-N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-9-methoxy-1-benzoxepine-4-carboxamide Traditional Name: 7-chloro-N-[5-(4-ethylbenzyl)thiazol-2-yl]-9-methoxy-1-benzoxepin-4-carboxamide Formula: C24H21ClN2O3S MolecularWeight: 452.95314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=CC(=CC(=C4OC=C3)OC)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=CC(=CC(=C4OC=C3)OC)Cl

InChI

InChI=1S/C24H21ClN2O3S/c1-3-15-4-6-16(7-5-15)10-20-14-26-24(31-20)27-23(28)17-8-9-30-22-18(11-17)12-19(25)13-21(22)29-2/h4-9,11-14H,3,10H2,1-2H3,(H,26,27,28)