1-(3-methylbutyl)-3-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[(3-morpholinosulfonylbenzoyl)amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(3-morpholin-4-ylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-isoamyl-3-[(3-morpholinosulfonylbenzoyl)amino]thiourea Formula: C17H26N4O4S2 MolecularWeight: 414.54274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H26N4O4S2/c1-13(2)6-7-18-17(26)20-19-16(22)14-4-3-5-15(12-14)27(23,24)21-8-10-25-11-9-21/h3-5,12-13H,6-11H2,1-2H3,(H,19,22)(H2,18,20,26)