4-(cyclopropylamino)-5-methyl-N-(quinolin-3-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(cyclopropylamino)-5-methyl-N-(quinolin-3-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(cyclopropylamino)-5-methyl-N-(3-quinolylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(cyclopropylamino)-5-methyl-N-(3-quinolinylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(cyclopropylamino)-5-methyl-N-(quinolin-3-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(cyclopropylamino)-5-methyl-N-(3-quinolylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3CC3)C(=O)NCC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3CC3)C(=O)NCC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C21H19N5OS/c1-12-17-19(26-15-6-7-15)24-11-25-21(17)28-18(12)20(27)23-10-13-8-14-4-2-3-5-16(14)22-9-13/h2-5,8-9,11,15H,6-7,10H2,1H3,(H,23,27)(H,24,25,26)