N4,N4-dimethyl-N2-[3-(thiophen-3-ylmethylamino)cyclohexyl]quinazoline-2,4-diamine

Systemtic Name: N4,N4-dimethyl-N2-[3-(thiophen-3-ylmethylamino)cyclohexyl]quinazoline-2,4-diamine Openeye Name: N4,N4-dimethyl-N2-[3-(3-thienylmethylamino)cyclohexyl]quinazoline-2,4-diamine CAS Name: N4,N4-dimethyl-N2-[3-(3-thiophenylmethylamino)cyclohexyl]quinazoline-2,4-diamine IUPAC Name: 4-N,4-N-dimethyl-2-N-[3-(thiophen-3-ylmethylamino)cyclohexyl]quinazoline-2,4-diamine Traditional Name: dimethyl-[2-[[3-(3-thenylamino)cyclohexyl]amino]quinazolin-4-yl]amine Formula: C21H27N5S MolecularWeight: 381.53758

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCCC(C3)NCC4=CSC=C4

Isomeric SMILES

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCCC(C3)NCC4=CSC=C4

InChI

InChI=1S/C21H27N5S/c1-26(2)20-18-8-3-4-9-19(18)24-21(25-20)23-17-7-5-6-16(12-17)22-13-15-10-11-27-14-15/h3-4,8-11,14,16-17,22H,5-7,12-13H2,1-2H3,(H,23,24,25)