1-(6-ethoxy-4-methyl-quinazolin-2-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]azepan-4-amine

Systemtic Name: 1-(6-ethoxy-4-methyl-quinazolin-2-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]azepan-4-amine Openeye Name: 1-(6-ethoxy-4-methyl-quinazolin-2-yl)-N-(2-thiazol-4-ylethyl)azepan-4-amine CAS Name: 1-(6-ethoxy-4-methyl-2-quinazolinyl)-N-[2-(4-thiazolyl)ethyl]-4-azepanamine IUPAC Name: 1-(6-ethoxy-4-methylquinazolin-2-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]azepan-4-amine Traditional Name: [1-(6-ethoxy-4-methyl-quinazolin-2-yl)azepan-4-yl]-(2-thiazol-4-ylethyl)amine Formula: C22H29N5OS MolecularWeight: 411.56356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCCC(CC3)NCCC4=CSC=N4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCCC(CC3)NCCC4=CSC=N4

InChI

InChI=1S/C22H29N5OS/c1-3-28-19-6-7-21-20(13-19)16(2)25-22(26-21)27-11-4-5-17(9-12-27)23-10-8-18-14-29-15-24-18/h6-7,13-15,17,23H,3-5,8-12H2,1-2H3