N-[2-chloranyl-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-phenyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[2-chloranyl-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-phenyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-phenyl]-4-(2-thienyl)butanamide CAS Name: N-[2-chloro-4-[[[(5-cyano-2-pyrazinyl)amino]-oxomethyl]amino]-5-methoxyphenyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxyphenyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxy-phenyl]-4-(2-thienyl)butyramide Formula: C21H19ClN6O3S MolecularWeight: 470.93196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC(=O)CCCC2=CC=CS2)Cl)NC(=O)NC3=NC=C(N=C3)C#N

Isomeric SMILES

COC1=C(C=C(C(=C1)NC(=O)CCCC2=CC=CS2)Cl)NC(=O)NC3=NC=C(N=C3)C#N

InChI

InChI=1S/C21H19ClN6O3S/c1-31-18-9-16(26-20(29)6-2-4-14-5-3-7-32-14)15(22)8-17(18)27-21(30)28-19-12-24-13(10-23)11-25-19/h3,5,7-9,11-12H,2,4,6H2,1H3,(H,26,29)(H2,25,27,28,30)