1-[(2R)-2-morpholin-4-yl-2-pyridin-3-yl-ethyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(2R)-2-morpholin-4-yl-2-pyridin-3-yl-ethyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(2R)-2-morpholino-2-(3-pyridyl)ethyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(2R)-2-(4-morpholinyl)-2-(3-pyridinyl)ethyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(2R)-2-morpholino-2-(3-pyridyl)ethyl]-3-(4-nitrophenyl)thiourea Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C3=CN=CC=C3

Isomeric SMILES

C1COCCN1[C@@H](CNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C3=CN=CC=C3

InChI

InChI=1S/C18H21N5O3S/c24-23(25)16-5-3-15(4-6-16)21-18(27)20-13-17(14-2-1-7-19-12-14)22-8-10-26-11-9-22/h1-7,12,17H,8-11,13H2,(H2,20,21,27)/t17-/m0/s1