1-(2-methoxyethyl)-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea Openeye Name: 1-(2-methoxyethyl)-3-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea CAS Name: 1-(2-methoxyethyl)-3-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)thiourea Traditional Name: 1-(2-methoxyethyl)-3-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)thiourea Formula: C18H28N4O4S2 MolecularWeight: 428.56932

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCC3

Isomeric SMILES

COCCNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCC3

InChI

InChI=1S/C18H28N4O4S2/c1-25-11-6-19-18(27)20-16-14-15(4-5-17(16)21-7-2-3-8-21)28(23,24)22-9-12-26-13-10-22/h4-5,14H,2-3,6-13H2,1H3,(H2,19,20,27)