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

Systemtic Name: 1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)thiourea CAS Name: 1-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-3-propan-2-ylthiourea IUPAC Name: 1-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)thiourea Formula: C18H28N4O3S2 MolecularWeight: 412.56992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O3S2/c1-14(2)19-18(26)20-16-13-15(5-6-17(16)21-7-3-4-8-21)27(23,24)22-9-11-25-12-10-22/h5-6,13-14H,3-4,7-12H2,1-2H3,(H2,19,20,26)