1-(1,3-benzodioxol-5-ylmethyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)thiourea Traditional Name: 1-(5-morpholinosulfonyl-2-piperidino-phenyl)-3-piperonyl-thiourea Formula: C24H30N4O5S2 MolecularWeight: 518.6488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H30N4O5S2/c29-35(30,28-10-12-31-13-11-28)19-5-6-21(27-8-2-1-3-9-27)20(15-19)26-24(34)25-16-18-4-7-22-23(14-18)33-17-32-22/h4-7,14-15H,1-3,8-13,16-17H2,(H2,25,26,34)