4-(4-ethoxyphenyl)sulfonyl-N-(3-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-ethoxyphenyl)sulfonyl-N-(3-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-ethoxyphenyl)sulfonyl-N-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-ethoxyphenyl)sulfonyl-N-(3-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-ethoxyphenyl)sulfonyl-N-(3-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(3-methoxyphenyl)-4-p-phenetylsulfonyl-piperazine-1-carbothioamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H25N3O4S2/c1-3-27-17-7-9-19(10-8-17)29(24,25)23-13-11-22(12-14-23)20(28)21-16-5-4-6-18(15-16)26-2/h4-10,15H,3,11-14H2,1-2H3,(H,21,28)