N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(phenylmethyl)-4-thiophen-2-yl-butanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(phenylmethyl)-4-thiophen-2-yl-butanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-benzyl-4-(2-thienyl)butanamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-(phenylmethyl)-4-thiophen-2-ylbutanamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-benzyl-4-thiophen-2-ylbutanamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-benzyl-4-(2-thienyl)butyramide Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C(=O)NC2=O)N(CC3=CC=CC=C3)C(=O)CCCC4=CC=CS4)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C(=O)NC2=O)N(CC3=CC=CC=C3)C(=O)CCCC4=CC=CS4)N

InChI

InChI=1S/C26H26N4O3S/c27-24-23(25(32)28-26(33)30(24)18-20-11-5-2-6-12-20)29(17-19-9-3-1-4-10-19)22(31)15-7-13-21-14-8-16-34-21/h1-6,8-12,14,16H,7,13,15,17-18,27H2,(H,28,32,33)