3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(phenylmethyl)-N-propan-2-yl-propanamide

Systemtic Name: 3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(phenylmethyl)-N-propan-2-yl-propanamide Openeye Name: N-benzyl-3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-isopropyl-propanamide CAS Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(phenylmethyl)-N-propan-2-ylpropanamide IUPAC Name: N-benzyl-3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-propan-2-ylpropanamide Traditional Name: N-benzyl-3-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-isopropyl-propionamide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C21H23ClN2O5S/c1-14(2)24(12-15-6-4-3-5-7-15)21(26)8-9-30(27,28)19-11-18-17(10-16(19)22)23-20(25)13-29-18/h3-7,10-11,14H,8-9,12-13H2,1-2H3,(H,23,25)