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

Systemtic Name: 1-(3-methylbutyl)-3-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[(4-morpholinosulfonylbenzoyl)amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(4-morpholin-4-ylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-isoamyl-3-[(4-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=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

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

InChI

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