3-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-oxidanylidene-N-(phenylmethyl)propanamide

Systemtic Name: 3-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-oxidanylidene-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-oxo-propanamide CAS Name: 3-[4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-3-oxo-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-oxopropanamide Traditional Name: N-benzyl-3-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-3-keto-propionamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2S/c1-2-17-12-18-21(24-15-25-22(18)30-17)27-10-8-26(9-11-27)20(29)13-19(28)23-14-16-6-4-3-5-7-16/h3-7,12,15H,2,8-11,13-14H2,1H3,(H,23,28)