1-(oxolan-2-ylmethyl)-3-[(4-pyrrol-1-ylphenyl)carbonylamino]thiourea

Systemtic Name: 1-(oxolan-2-ylmethyl)-3-[(4-pyrrol-1-ylphenyl)carbonylamino]thiourea Openeye Name: 1-[(4-pyrrol-1-ylbenzoyl)amino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-(2-oxolanylmethyl)-3-[[oxo-[4-(1-pyrrolyl)phenyl]methyl]amino]thiourea IUPAC Name: 1-(oxolan-2-ylmethyl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea Traditional Name: 1-[(4-pyrrol-1-ylbenzoyl)amino]-3-(tetrahydrofurfuryl)thiourea Formula: C17H20N4O2S MolecularWeight: 344.4313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NNC(=O)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

C1CC(OC1)CNC(=S)NNC(=O)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C17H20N4O2S/c22-16(19-20-17(24)18-12-15-4-3-11-23-15)13-5-7-14(8-6-13)21-9-1-2-10-21/h1-2,5-10,15H,3-4,11-12H2,(H,19,22)(H2,18,20,24)