1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[(Z)-1-(3-nitrophenyl)butylideneamino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C16H22N4O3S MolecularWeight: 350.43588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=S)NCC1CCCO1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC/C(=N/NC(=S)NC[C@H]1CCCO1)/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O3S/c1-2-5-15(12-6-3-7-13(10-12)20(21)22)18-19-16(24)17-11-14-8-4-9-23-14/h3,6-7,10,14H,2,4-5,8-9,11H2,1H3,(H2,17,19,24)/b18-15-/t14-/m1/s1