3-(2,5-dimethylphenyl)-1-(furan-2-ylmethyl)-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-(2,5-dimethylphenyl)-1-(furan-2-ylmethyl)-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-(2,5-dimethylphenyl)-1-(2-furylmethyl)-1-(3-morpholinopropyl)thiourea CAS Name: 3-(2,5-dimethylphenyl)-1-(2-furanylmethyl)-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-(2,5-dimethylphenyl)-1-(furan-2-ylmethyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-(2,5-dimethylphenyl)-1-(2-furfuryl)-1-(3-morpholinopropyl)thiourea Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(CCCN2CCOCC2)CC3=CC=CO3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(CCCN2CCOCC2)CC3=CC=CO3

InChI

InChI=1S/C21H29N3O2S/c1-17-6-7-18(2)20(15-17)22-21(27)24(16-19-5-3-12-26-19)9-4-8-23-10-13-25-14-11-23/h3,5-7,12,15H,4,8-11,13-14,16H2,1-2H3,(H,22,27)