1-butyl-3-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)urea

Systemtic Name: 1-butyl-3-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)urea Openeye Name: 1-butyl-3-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)urea CAS Name: 1-butyl-3-[4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinyl]urea IUPAC Name: 1-butyl-3-(4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)urea Traditional Name: 1-butyl-3-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)urea Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C(C2=C(S1)N=C(C=C2C)C)N3C=CC=C3

Isomeric SMILES

CCCCNC(=O)NC1=C(C2=C(S1)N=C(C=C2C)C)N3C=CC=C3

InChI

InChI=1S/C18H22N4OS/c1-4-5-8-19-18(23)21-17-15(22-9-6-7-10-22)14-12(2)11-13(3)20-16(14)24-17/h6-7,9-11H,4-5,8H2,1-3H3,(H2,19,21,23)