1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-(3-morpholinopropyl)-3-(4-nitrophenyl)-1-(4-pyridylmethyl)thiourea CAS Name: 1-[3-(4-morpholinyl)propyl]-3-(4-nitrophenyl)-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-(3-morpholinopropyl)-3-(4-nitrophenyl)-1-(4-pyridylmethyl)thiourea Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(CC2=CC=NC=C2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCCN(CC2=CC=NC=C2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O3S/c26-25(27)19-4-2-18(3-5-19)22-20(29)24(16-17-6-8-21-9-7-17)11-1-10-23-12-14-28-15-13-23/h2-9H,1,10-16H2,(H,22,29)