6-chloranyl-2-[(3-methoxyphenyl)methyl]-1,1-bis(oxidanylidene)-4-(phenylmethyl)-8-piperazin-1-yl-1$l^{6},2,4-benzothiadiazin-3-one

Systemtic Name: 6-chloranyl-2-[(3-methoxyphenyl)methyl]-1,1-bis(oxidanylidene)-4-(phenylmethyl)-8-piperazin-1-yl-1$l^{6},2,4-benzothiadiazin-3-one Openeye Name: 4-benzyl-6-chloro-2-[(3-methoxyphenyl)methyl]-1,1-dioxo-8-piperazin-1-yl-1$l^{6},2,4-benzothiadiazin-3-one CAS Name: 6-chloro-2-[(3-methoxyphenyl)methyl]-1,1-dioxo-4-(phenylmethyl)-8-(1-piperazinyl)-1$l^{6},2,4-benzothiadiazin-3-one IUPAC Name: 4-benzyl-6-chloro-2-[(3-methoxyphenyl)methyl]-1,1-dioxo-8-piperazin-1-yl-1$l^{6},2,4-benzothiadiazin-3-one Traditional Name: 4-benzyl-6-chloro-1,1-diketo-2-m-anisyl-8-piperazino-1$l^{6},2,4-benzothiadiazin-3-one Formula: C26H27ClN4O4S MolecularWeight: 527.03498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C(=O)N(C3=CC(=CC(=C3S2(=O)=O)N4CCNCC4)Cl)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)CN2C(=O)N(C3=CC(=CC(=C3S2(=O)=O)N4CCNCC4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C26H27ClN4O4S/c1-35-22-9-5-8-20(14-22)18-31-26(32)30(17-19-6-3-2-4-7-19)24-16-21(27)15-23(25(24)36(31,33)34)29-12-10-28-11-13-29/h2-9,14-16,28H,10-13,17-18H2,1H3