(6-chloranyl-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylmethanamine

Systemtic Name: (6-chloranyl-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylmethanamine Openeye Name: (6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylmethanamine CAS Name: (6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylmethanamine IUPAC Name: (6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylmethanamine Traditional Name: (6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylmethylamine Formula: C16H18ClN3O2S2 MolecularWeight: 383.91602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2NC3=CC(=C(C=C3SN2)S(=O)(=O)CN)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2NC3=CC(=C(C=C3SN2)S(=O)(=O)CN)Cl

InChI

InChI=1S/C16H18ClN3O2S2/c17-12-8-13-14(9-15(12)24(21,22)10-18)23-20-16(19-13)7-6-11-4-2-1-3-5-11/h1-5,8-9,16,19-20H,6-7,10,18H2