2-[[4-(cycloheptylamino)-6-(1-pyrrolidin-2-ylpropylamino)-1,3,5-triazin-2-yl]amino]-4-methyl-thiophene-3-carboxamide

Systemtic Name: 2-[[4-(cycloheptylamino)-6-(1-pyrrolidin-2-ylpropylamino)-1,3,5-triazin-2-yl]amino]-4-methyl-thiophene-3-carboxamide Openeye Name: 2-[[4-(cycloheptylamino)-6-(1-pyrrolidin-2-ylpropylamino)-1,3,5-triazin-2-yl]amino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[4-(cycloheptylamino)-6-[1-(2-pyrrolidinyl)propylamino]-1,3,5-triazin-2-yl]amino]-4-methyl-3-thiophenecarboxamide IUPAC Name: 2-[[4-(cycloheptylamino)-6-(1-pyrrolidin-2-ylpropylamino)-1,3,5-triazin-2-yl]amino]-4-methylthiophene-3-carboxamide Traditional Name: 2-[[4-(cycloheptylamino)-6-(1-pyrrolidin-2-ylpropylamino)-s-triazin-2-yl]amino]-4-methyl-thiophene-3-carboxamide Formula: C23H36N8OS MolecularWeight: 472.64994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCN1)NC2=NC(=NC(=N2)NC3CCCCCC3)NC4=C(C(=CS4)C)C(=O)N

Isomeric SMILES

CCC(C1CCCN1)NC2=NC(=NC(=N2)NC3CCCCCC3)NC4=C(C(=CS4)C)C(=O)N

InChI

InChI=1S/C23H36N8OS/c1-3-16(17-11-8-12-25-17)27-22-29-21(26-15-9-6-4-5-7-10-15)30-23(31-22)28-20-18(19(24)32)14(2)13-33-20/h13,15-17,25H,3-12H2,1-2H3,(H2,24,32)(H3,26,27,28,29,30,31)