3-(2-ethylphenyl)-1-(furan-2-ylmethyl)-1-(3-pyrrolidin-1-ylpropyl)thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-(furan-2-ylmethyl)-1-(3-pyrrolidin-1-ylpropyl)thiourea Openeye Name: 3-(2-ethylphenyl)-1-(2-furylmethyl)-1-(3-pyrrolidin-1-ylpropyl)thiourea CAS Name: 3-(2-ethylphenyl)-1-(2-furanylmethyl)-1-[3-(1-pyrrolidinyl)propyl]thiourea IUPAC Name: 3-(2-ethylphenyl)-1-(furan-2-ylmethyl)-1-(3-pyrrolidin-1-ylpropyl)thiourea Traditional Name: 3-(2-ethylphenyl)-1-(2-furfuryl)-1-(3-pyrrolidinopropyl)thiourea Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CCCN2CCCC2)CC3=CC=CO3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CCCN2CCCC2)CC3=CC=CO3

InChI

InChI=1S/C21H29N3OS/c1-2-18-9-3-4-11-20(18)22-21(26)24(17-19-10-7-16-25-19)15-8-14-23-12-5-6-13-23/h3-4,7,9-11,16H,2,5-6,8,12-15,17H2,1H3,(H,22,26)