5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide

Systemtic Name: 5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide Openeye Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(m-tolylmethyl)thiophene-2-carboxamide CAS Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(3-methylphenyl)methyl]-2-thiophenecarboxamide IUPAC Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide Traditional Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(3-methylbenzyl)thiophene-2-carboxamide Formula: C21H19ClN2O2S MolecularWeight: 398.90576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN2O2S/c1-14-3-2-4-15(11-14)13-23-21(25)19-7-8-20(27-19)24-9-10-26-18-6-5-16(22)12-17(18)24/h2-8,11-12H,9-10,13H2,1H3,(H,23,25)