N-[4-[(phenylmethyl)sulfamoyl]phenyl]-4-[(2-prop-2-enoxyphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-[4-[(phenylmethyl)sulfamoyl]phenyl]-4-[(2-prop-2-enoxyphenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-[(2-allyloxyphenyl)methyl]-N-[4-(benzylsulfamoyl)phenyl]piperazine-1-carbothioamide CAS Name: N-[4-[(phenylmethyl)sulfamoyl]phenyl]-4-[(2-prop-2-enoxyphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[4-(benzylsulfamoyl)phenyl]-4-[(2-prop-2-enoxyphenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(2-allyloxybenzyl)-N-[4-(benzylsulfamoyl)phenyl]piperazine-1-carbothioamide Formula: C28H32N4O3S2 MolecularWeight: 536.70868

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

C=CCOC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O3S2/c1-2-20-35-27-11-7-6-10-24(27)22-31-16-18-32(19-17-31)28(36)30-25-12-14-26(15-13-25)37(33,34)29-21-23-8-4-3-5-9-23/h2-15,29H,1,16-22H2,(H,30,36)