1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-morpholinosulfonylbenzoyl)amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-morpholin-4-ylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-[(3-morpholinosulfonylbenzoyl)amino]-3-piperonyl-thiourea Formula: C20H22N4O6S2 MolecularWeight: 478.54188

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N4O6S2/c25-19(15-2-1-3-16(11-15)32(26,27)24-6-8-28-9-7-24)22-23-20(31)21-12-14-4-5-17-18(10-14)30-13-29-17/h1-5,10-11H,6-9,12-13H2,(H,22,25)(H2,21,23,31)