1-[[3-(cyclopropylsulfamoyl)-4-methoxy-phenyl]carbonylamino]-3-pentyl-thiourea

Systemtic Name: 1-[[3-(cyclopropylsulfamoyl)-4-methoxy-phenyl]carbonylamino]-3-pentyl-thiourea Openeye Name: 1-[[3-(cyclopropylsulfamoyl)-4-methoxy-benzoyl]amino]-3-pentyl-thiourea CAS Name: 1-[[[3-(cyclopropylsulfamoyl)-4-methoxyphenyl]-oxomethyl]amino]-3-pentylthiourea IUPAC Name: 1-[[3-(cyclopropylsulfamoyl)-4-methoxybenzoyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[3-(cyclopropylsulfamoyl)-4-methoxy-benzoyl]amino]thiourea Formula: C17H26N4O4S2 MolecularWeight: 414.54274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)NC2CC2

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)NC2CC2

InChI

InChI=1S/C17H26N4O4S2/c1-3-4-5-10-18-17(26)20-19-16(22)12-6-9-14(25-2)15(11-12)27(23,24)21-13-7-8-13/h6,9,11,13,21H,3-5,7-8,10H2,1-2H3,(H,19,22)(H2,18,20,26)