1-[2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]-3-methyl-1-phenethyl-thiourea

Systemtic Name: 1-[2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]-3-methyl-1-phenethyl-thiourea Openeye Name: 1-[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-3-methyl-1-phenethyl-thiourea CAS Name: 1-[2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]-3-methyl-1-phenethylthiourea IUPAC Name: 1-[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-3-methyl-1-phenethylthiourea Traditional Name: 1-[2,5-diketo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-3-methyl-1-phenethyl-thiourea Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=S)NC

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=S)NC

InChI

InChI=1S/C23H27N3O3S/c1-3-15-29-19-11-9-18(10-12-19)26-21(27)16-20(22(26)28)25(23(30)24-2)14-13-17-7-5-4-6-8-17/h4-12,20H,3,13-16H2,1-2H3,(H,24,30)